(E)-3-(4-chlorophenyl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide

Systemtic Name: (E)-3-(4-chlorophenyl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Openeye Name: (E)-3-(4-chlorophenyl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide CAS Name: (E)-3-(4-chlorophenyl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-2-propenamide IUPAC Name: (E)-3-(4-chlorophenyl)-2-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)prop-2-enamide Traditional Name: (E)-3-(4-chlorophenyl)-2-cyano-N-(6-mesyl-1,3-benzothiazol-2-yl)acrylamide Formula: C18H12ClN3O3S2 MolecularWeight: 417.88918

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C(=CC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

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

InChI

InChI=1S/C18H12ClN3O3S2/c1-27(24,25)14-6-7-15-16(9-14)26-18(21-15)22-17(23)12(10-20)8-11-2-4-13(19)5-3-11/h2-9H,1H3,(H,21,22,23)/b12-8+