N-(1,3-benzothiazol-2-yl)-3-[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)pyridin-2-yl]sulfanyl-propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-[[3-cyano-6-(4-methoxyphenyl)-4-(p-tolyl)-2-pyridyl]sulfanyl]propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-[[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)-2-pyridinyl]thio]propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-[3-cyano-6-(4-methoxyphenyl)-4-(4-methylphenyl)pyridin-2-yl]sulfanylpropanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-[[3-cyano-6-(4-methoxyphenyl)-4-(p-tolyl)-2-pyridyl]thio]propionamide Formula: C30H24N4O2S2 MolecularWeight: 536.66716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCCC(=O)NC3=NC4=CC=CC=C4S3)C5=CC=C(C=C5)OC

InChI

InChI=1S/C30H24N4O2S2/c1-19-7-9-20(10-8-19)23-17-26(21-11-13-22(36-2)14-12-21)32-29(24(23)18-31)37-16-15-28(35)34-30-33-25-5-3-4-6-27(25)38-30/h3-14,17H,15-16H2,1-2H3,(H,33,34,35)