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

Systemtic Name: 2-[6-azanyl-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(2-ethyl-6-methyl-phenyl)butanamide Openeye Name: 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]sulfanyl]-N-(2-ethyl-6-methyl-phenyl)butanamide CAS Name: 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridinyl]thio]-N-(2-ethyl-6-methylphenyl)butanamide IUPAC Name: 2-[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)pyridin-2-yl]sulfanyl-N-(2-ethyl-6-methylphenyl)butanamide Traditional Name: 2-[[6-amino-3,5-dicyano-4-(3,4,5-trimethoxyphenyl)-2-pyridyl]thio]-N-(2-ethyl-6-methyl-phenyl)butyramide Formula: C29H31N5O4S MolecularWeight: 545.65254

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=C(C(=C(C(=N2)N)C#N)C3=CC(=C(C(=C3)OC)OC)OC)C#N)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C(CC)SC2=C(C(=C(C(=N2)N)C#N)C3=CC(=C(C(=C3)OC)OC)OC)C#N)C

InChI

InChI=1S/C29H31N5O4S/c1-7-17-11-9-10-16(3)25(17)33-28(35)23(8-2)39-29-20(15-31)24(19(14-30)27(32)34-29)18-12-21(36-4)26(38-6)22(13-18)37-5/h9-13,23H,7-8H2,1-6H3,(H2,32,34)(H,33,35)