3-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)propanamide

Systemtic Name: 3-[6-azanyl-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)propanamide Openeye Name: 3-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]sulfanyl]-N-(4-chloro-2-methoxy-5-methyl-phenyl)propanamide CAS Name: 3-[[6-amino-3,5-dicyano-4-(4-methylphenyl)-2-pyridinyl]thio]-N-(4-chloro-2-methoxy-5-methylphenyl)propanamide IUPAC Name: 3-[6-amino-3,5-dicyano-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-N-(4-chloro-2-methoxy-5-methylphenyl)propanamide Traditional Name: 3-[[6-amino-3,5-dicyano-4-(p-tolyl)-2-pyridyl]thio]-N-(4-chloro-2-methoxy-5-methyl-phenyl)propionamide Formula: C25H22ClN5O2S MolecularWeight: 491.99248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22ClN5O2S/c1-14-4-6-16(7-5-14)23-17(12-27)24(29)31-25(18(23)13-28)34-9-8-22(32)30-20-10-15(2)19(26)11-21(20)33-3/h4-7,10-11H,8-9H2,1-3H3,(H2,29,31)(H,30,32)