4-(5-cycloheptylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzenecarbonitrile

Systemtic Name: 4-(5-cycloheptylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzenecarbonitrile Openeye Name: 4-(5-cycloheptylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzonitrile CAS Name: 4-(5-cycloheptylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzonitrile IUPAC Name: 4-(5-cycloheptylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzonitrile Traditional Name: 4-(5-cycloheptylimino-4-methyl-1,3,4-thiadiazol-2-yl)benzonitrile Formula: C17H20N4S MolecularWeight: 312.4325

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2CCCCCC2)SC(=N1)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C(=NC2CCCCCC2)SC(=N1)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H20N4S/c1-21-17(19-15-6-4-2-3-5-7-15)22-16(20-21)14-10-8-13(12-18)9-11-14/h8-11,15H,2-7H2,1H3