2-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N,N-diphenyl-butanamide

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N,N-diphenyl-butanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]sulfanyl]-N,N-diphenyl-butanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(4-methylphenyl)-2-pyridinyl]thio]-N,N-diphenylbutanamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N,N-diphenylbutanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]thio]-N,N-diphenyl-butyramide Formula: C30H25N5OS MolecularWeight: 503.6174

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=C(C(=C(C(=N3)N)C#N)C4=CC=C(C=C4)C)C#N

Isomeric SMILES

CCC(C(=O)N(C1=CC=CC=C1)C2=CC=CC=C2)SC3=C(C(=C(C(=N3)N)C#N)C4=CC=C(C=C4)C)C#N

InChI

InChI=1S/C30H25N5OS/c1-3-26(30(36)35(22-10-6-4-7-11-22)23-12-8-5-9-13-23)37-29-25(19-32)27(24(18-31)28(33)34-29)21-16-14-20(2)15-17-21/h4-17,26H,3H2,1-2H3,(H2,33,34)