3-(4-chlorophenyl)-3-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxidanylidene-propanamide

Systemtic Name: 3-(4-chlorophenyl)-3-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxidanylidene-propanamide Openeye Name: 3-(4-chlorophenyl)-3-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxo-propanamide CAS Name: 3-(4-chlorophenyl)-3-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxopropanamide IUPAC Name: 3-(4-chlorophenyl)-3-cyano-N-(6-methyl-1,3-benzothiazol-2-yl)-2-oxopropanamide Traditional Name: 3-(4-chlorophenyl)-3-cyano-2-keto-N-(6-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C18H12ClN3O2S MolecularWeight: 369.82478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)C(C#N)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)C(=O)C(C#N)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H12ClN3O2S/c1-10-2-7-14-15(8-10)25-18(21-14)22-17(24)16(23)13(9-20)11-3-5-12(19)6-4-11/h2-8,13H,1H3,(H,21,22,24)