2-[[4-cyano-3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[[4-cyano-3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[3-(2-anilino-2-oxo-ethyl)sulfanyl-4-cyano-isothiazol-5-yl]sulfanyl-N-phenyl-acetamide CAS Name: 2-[[3-[(2-anilino-2-oxoethyl)thio]-4-cyano-5-isothiazolyl]thio]-N-phenylacetamide IUPAC Name: 2-[[3-(2-anilino-2-oxoethyl)sulfanyl-4-cyano-1,2-thiazol-5-yl]sulfanyl]-N-phenylacetamide Traditional Name: 2-[[3-[(2-anilino-2-keto-ethyl)thio]-4-cyano-isothiazol-5-yl]thio]-N-phenyl-acetamide Formula: C20H16N4O2S3 MolecularWeight: 440.56164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CSC2=C(C(=NS2)SCC(=O)NC3=CC=CC=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CSC2=C(C(=NS2)SCC(=O)NC3=CC=CC=C3)C#N

InChI

InChI=1S/C20H16N4O2S3/c21-11-16-19(27-12-17(25)22-14-7-3-1-4-8-14)24-29-20(16)28-13-18(26)23-15-9-5-2-6-10-15/h1-10H,12-13H2,(H,22,25)(H,23,26)