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

Systemtic Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-oxidanylidene-1-(phenylmethyl)pyridine-3-carboxamide Openeye Name: 1-benzyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-oxo-pyridine-3-carboxamide CAS Name: N-(6-nitro-1,3-benzothiazol-2-yl)-2-oxo-1-(phenylmethyl)-3-pyridinecarboxamide IUPAC Name: 1-benzyl-N-(6-nitro-1,3-benzothiazol-2-yl)-2-oxopyridine-3-carboxamide Traditional Name: 1-benzyl-2-keto-N-(6-nitro-1,3-benzothiazol-2-yl)nicotinamide Formula: C20H14N4O4S MolecularWeight: 406.41456

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC=C(C2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC=C(C2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O4S/c25-18(22-20-21-16-9-8-14(24(27)28)11-17(16)29-20)15-7-4-10-23(19(15)26)12-13-5-2-1-3-6-13/h1-11H,12H2,(H,21,22,25)