3-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-(3-cyano-4,6-diphenyl-pyridin-2-yl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[(3-cyano-4,6-diphenyl-2-pyridyl)sulfanyl]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(3-cyano-4,6-diphenyl-2-pyridinyl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-(3-cyano-4,6-diphenylpyridin-2-yl)sulfanyl-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[(3-cyano-4,6-diphenyl-2-pyridyl)thio]-N-(6-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C29H22N4OS2 MolecularWeight: 506.64118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCSC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCSC3=C(C(=CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5)C#N

InChI

InChI=1S/C29H22N4OS2/c1-19-12-13-24-26(16-19)36-29(32-24)33-27(34)14-15-35-28-23(18-30)22(20-8-4-2-5-9-20)17-25(31-28)21-10-6-3-7-11-21/h2-13,16-17H,14-15H2,1H3,(H,32,33,34)