N-[4-(cyanomethyl)phenyl]-3-methyl-2-oxidanylidene-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-3-methyl-2-oxidanylidene-1,3-benzothiazole-6-sulfonamide Openeye Name: N-[4-(cyanomethyl)phenyl]-3-methyl-2-oxo-1,3-benzothiazole-6-sulfonamide CAS Name: N-[4-(cyanomethyl)phenyl]-3-methyl-2-oxo-1,3-benzothiazole-6-sulfonamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-3-methyl-2-oxo-1,3-benzothiazole-6-sulfonamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-keto-3-methyl-1,3-benzothiazole-6-sulfonamide Formula: C16H13N3O3S2 MolecularWeight: 359.42272

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)CC#N)SC1=O

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=C(C=C3)CC#N)SC1=O

InChI

InChI=1S/C16H13N3O3S2/c1-19-14-7-6-13(10-15(14)23-16(19)20)24(21,22)18-12-4-2-11(3-5-12)8-9-17/h2-7,10,18H,8H2,1H3