3-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide

Systemtic Name: 3-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Openeye Name: 3-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide CAS Name: 3-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide IUPAC Name: 3-cyano-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)benzamide Traditional Name: 3-cyano-N-(6-mesyl-1,3-benzothiazol-2-yl)benzamide Formula: C16H11N3O3S2 MolecularWeight: 357.40684

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11N3O3S2/c1-24(21,22)12-5-6-13-14(8-12)23-16(18-13)19-15(20)11-4-2-3-10(7-11)9-17/h2-8H,1H3,(H,18,19,20)