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

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N,N-diphenyl-butanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]sulfanyl]-N,N-diphenyl-butanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]thio]-N,N-diphenylbutanamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N,N-diphenylbutanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]thio]-N,N-diphenyl-butyramide Formula: C32H29N5O4S MolecularWeight: 579.66876

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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)OC)OC)OC)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)OC)OC)OC)C#N

InChI

InChI=1S/C32H29N5O4S/c1-5-27(32(38)37(21-12-8-6-9-13-21)22-14-10-7-11-15-22)42-31-24(19-34)28(23(18-33)30(35)36-31)20-16-25(39-2)29(41-4)26(17-20)40-3/h6-17,27H,5H2,1-4H3,(H2,35,36)