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

Systemtic Name: 3-[6-azanyl-3,5-dicyano-4-(4-propan-2-ylphenyl)pyridin-2-yl]sulfanyl-N-(5-chloranyl-2-methoxy-phenyl)propanamide Openeye Name: 3-[[6-amino-3,5-dicyano-4-(4-isopropylphenyl)-2-pyridyl]sulfanyl]-N-(5-chloro-2-methoxy-phenyl)propanamide CAS Name: 3-[[6-amino-3,5-dicyano-4-(4-propan-2-ylphenyl)-2-pyridinyl]thio]-N-(5-chloro-2-methoxyphenyl)propanamide IUPAC Name: 3-[6-amino-3,5-dicyano-4-(4-propan-2-ylphenyl)pyridin-2-yl]sulfanyl-N-(5-chloro-2-methoxyphenyl)propanamide Traditional Name: 3-[(6-amino-3,5-dicyano-4-p-cumenyl-2-pyridyl)thio]-N-(5-chloro-2-methoxy-phenyl)propionamide Formula: C26H24ClN5O2S MolecularWeight: 506.01906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H24ClN5O2S/c1-15(2)16-4-6-17(7-5-16)24-19(13-28)25(30)32-26(20(24)14-29)35-11-10-23(33)31-21-12-18(27)8-9-22(21)34-3/h4-9,12,15H,10-11H2,1-3H3,(H2,30,32)(H,31,33)