3-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-methylpyridin-2-yl)propanamide

Systemtic Name: 3-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-pyridin-2-yl]sulfanyl-N-(4-methylpyridin-2-yl)propanamide Openeye Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]sulfanyl]-N-(4-methyl-2-pyridyl)propanamide CAS Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridinyl]thio]-N-(4-methyl-2-pyridinyl)propanamide IUPAC Name: 3-[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-(4-methylpyridin-2-yl)propanamide Traditional Name: 3-[[3-cyano-4-(2,3-dimethoxyphenyl)-6-phenyl-2-pyridyl]thio]-N-(4-methyl-2-pyridyl)propionamide Formula: C29H26N4O3S MolecularWeight: 510.60674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)NC(=O)CCSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C(=CC=C4)OC)OC)C#N

Isomeric SMILES

CC1=CC(=NC=C1)NC(=O)CCSC2=C(C(=CC(=N2)C3=CC=CC=C3)C4=C(C(=CC=C4)OC)OC)C#N

InChI

InChI=1S/C29H26N4O3S/c1-19-12-14-31-26(16-19)33-27(34)13-15-37-29-23(18-30)22(17-24(32-29)20-8-5-4-6-9-20)21-10-7-11-25(35-2)28(21)36-3/h4-12,14,16-17H,13,15H2,1-3H3,(H,31,33,34)