(1R,5S)-N-[[2,3-bis(chloranyl)phenyl]methyl]-7-[4-[[3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-N-cyclopropyl-3,9-diazabicyclo[3.3.1]non-6-ene-6-carboxamide

Systemtic Name: (1R,5S)-N-[[2,3-bis(chloranyl)phenyl]methyl]-7-[4-[[3-(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-N-cyclopropyl-3,9-diazabicyclo[3.3.1]non-6-ene-6-carboxamide Openeye Name: (1R,5S)-7-[4-[[3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]-3,9-diazabicyclo[3.3.1]non-6-ene-6-carboxamide CAS Name: (1R,5S)-7-[4-[[3-(5-chloro-1,3-dimethyl-4-pyrazolyl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]-3,9-diazabicyclo[3.3.1]non-6-ene-6-carboxamide IUPAC Name: (1R,5S)-7-[4-[[3-(5-chloro-1,3-dimethylpyrazol-4-yl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-N-cyclopropyl-N-[(2,3-dichlorophenyl)methyl]-3,9-diazabicyclo[3.3.1]non-6-ene-6-carboxamide Traditional Name: (1R,5S)-7-[4-[[3-(5-chloro-1,3-dimethyl-pyrazol-4-yl)-1,2,4-oxadiazol-5-yl]methoxy]phenyl]-N-cyclopropyl-N-(2,3-dichlorobenzyl)-3,9-diazabicyclo[3.3.1]non-6-ene-6-carboxamide Formula: C32H32Cl3N7O3 MolecularWeight: 669.00058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=NOC(=N2)COC3=CC=C(C=C3)C4=C(C5CNCC(C4)N5)C(=O)N(CC6=C(C(=CC=C6)Cl)Cl)C7CC7)Cl)C

Isomeric SMILES

CC1=NN(C(=C1C2=NOC(=N2)COC3=CC=C(C=C3)C4=C([C@H]5CNC[C@@H](C4)N5)C(=O)N(CC6=C(C(=CC=C6)Cl)Cl)C7CC7)Cl)C

InChI

InChI=1S/C32H32Cl3N7O3/c1-17-27(30(35)41(2)39-17)31-38-26(45-40-31)16-44-22-10-6-18(7-11-22)23-12-20-13-36-14-25(37-20)28(23)32(43)42(21-8-9-21)15-19-4-3-5-24(33)29(19)34/h3-7,10-11,20-21,25,36-37H,8-9,12-16H2,1-2H3/t20-,25-/m1/s1