4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide

Systemtic Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide Openeye Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(3-pyridylmethyl)benzamide CAS Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(3-pyridinylmethyl)benzamide IUPAC Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(pyridin-3-ylmethyl)benzamide Traditional Name: 4-(5-cyclohexylimino-4-methyl-1,3,4-thiadiazol-2-yl)-N-(3-pyridylmethyl)benzamide Formula: C22H25N5OS MolecularWeight: 407.5318

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2CCCCC2)SC(=N1)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

CN1C(=NC2CCCCC2)SC(=N1)C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C22H25N5OS/c1-27-22(25-19-7-3-2-4-8-19)29-21(26-27)18-11-9-17(10-12-18)20(28)24-15-16-6-5-13-23-14-16/h5-6,9-14,19H,2-4,7-8,15H2,1H3,(H,24,28)