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

Systemtic Name: 3-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)propanamide Openeye Name: 3-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(3,5-dimethoxyphenyl)propanamide CAS Name: 3-[[6-amino-3,5-dicyano-4-(4-methylphenyl)-2-pyridinyl]thio]-N-(3,5-dimethoxyphenyl)propanamide IUPAC Name: 3-[6-amino-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(3,5-dimethoxyphenyl)propanamide Traditional Name: 3-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]thio]-N-(3,5-dimethoxyphenyl)propionamide Formula: C25H23N5O3S MolecularWeight: 473.54682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SCCC(=O)NC3=CC(=CC(=C3)OC)OC)N)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SCCC(=O)NC3=CC(=CC(=C3)OC)OC)N)C#N

InChI

InChI=1S/C25H23N5O3S/c1-15-4-6-16(7-5-15)23-20(13-26)24(28)30-25(21(23)14-27)34-9-8-22(31)29-17-10-18(32-2)12-19(11-17)33-3/h4-7,10-12H,8-9H2,1-3H3,(H2,28,30)(H,29,31)