N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxidanylidene-propyl]-N-cyclohexyl-4-pentyl-benzamide

Systemtic Name: N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxidanylidene-propyl]-N-cyclohexyl-4-pentyl-benzamide Openeye Name: N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxo-propyl]-N-cyclohexyl-4-pentyl-benzamide CAS Name: N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxopropyl]-N-cyclohexyl-4-pentylbenzamide IUPAC Name: N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-oxopropyl]-N-cyclohexyl-4-pentylbenzamide Traditional Name: 4-amyl-N-[3-[[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]amino]-3-keto-propyl]-N-cyclohexyl-benzamide Formula: C29H35BrN4O2S MolecularWeight: 583.5828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N(CCC(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Br)C4CCCCC4

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N(CCC(=O)NC2=NN=C(S2)C3=CC=C(C=C3)Br)C4CCCCC4

InChI

InChI=1S/C29H35BrN4O2S/c1-2-3-5-8-21-11-13-23(14-12-21)28(36)34(25-9-6-4-7-10-25)20-19-26(35)31-29-33-32-27(37-29)22-15-17-24(30)18-16-22/h11-18,25H,2-10,19-20H2,1H3,(H,31,33,35)