N-[(1R)-2-(cyclohexylamino)-1-(4-dimethylaminophenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-[(1R)-2-(cyclohexylamino)-1-(4-dimethylaminophenyl)-2-oxidanylidene-ethyl]-N-cyclopropyl-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-[(1R)-2-(cyclohexylamino)-1-(4-dimethylaminophenyl)-2-oxo-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide CAS Name: N-[(1R)-2-(cyclohexylamino)-1-(4-dimethylaminophenyl)-2-oxoethyl]-N-cyclopropyl-4-thiadiazolecarboxamide IUPAC Name: N-[(1R)-2-(cyclohexylamino)-1-(4-dimethylaminophenyl)-2-oxoethyl]-N-cyclopropylthiadiazole-4-carboxamide Traditional Name: N-[(1R)-2-(cyclohexylamino)-1-(4-dimethylaminophenyl)-2-keto-ethyl]-N-cyclopropyl-thiadiazole-4-carboxamide Formula: C22H29N5O2S MolecularWeight: 427.56296

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C(=O)NC2CCCCC2)N(C3CC3)C(=O)C4=CSN=N4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](C(=O)NC2CCCCC2)N(C3CC3)C(=O)C4=CSN=N4

InChI

InChI=1S/C22H29N5O2S/c1-26(2)17-10-8-15(9-11-17)20(21(28)23-16-6-4-3-5-7-16)27(18-12-13-18)22(29)19-14-30-25-24-19/h8-11,14,16,18,20H,3-7,12-13H2,1-2H3,(H,23,28)/t20-/m1/s1