N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxidanylidene-1-(phenylmethyl)pyridine-3-carboxamide

Systemtic Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxidanylidene-1-(phenylmethyl)pyridine-3-carboxamide Openeye Name: 1-benzyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxo-pyridine-3-carboxamide CAS Name: N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxo-1-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: 1-benzyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-oxopyridine-3-carboxamide Traditional Name: 1-benzyl-6-keto-N-(6-mesyl-1,3-benzothiazol-2-yl)nicotinamide Formula: C21H17N3O4S2 MolecularWeight: 439.50738

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(C(=O)C=C3)CC4=CC=CC=C4

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CN(C(=O)C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C21H17N3O4S2/c1-30(27,28)16-8-9-17-18(11-16)29-21(22-17)23-20(26)15-7-10-19(25)24(13-15)12-14-5-3-2-4-6-14/h2-11,13H,12H2,1H3,(H,22,23,26)