N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(3-cyano-4-methyl-6-oxidanylidene-1H-pyridin-2-yl)sulfanyl]ethanamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)thio]acetamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(3-cyano-4-methyl-6-oxo-1H-pyridin-2-yl)sulfanyl]acetamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-2-[(3-cyano-6-keto-4-methyl-1H-pyridin-2-yl)thio]acetamide Formula: C23H18N4O2S2 MolecularWeight: 446.54462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=O)NC(=C1C#N)SCC(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H18N4O2S2/c1-14-10-20(28)27-23(17(14)12-24)30-13-21(29)25-16-8-6-15(7-9-16)11-22-26-18-4-2-3-5-19(18)31-22/h2-10H,11,13H2,1H3,(H,25,29)(H,27,28)