2-(1,3-benzothiazol-2-yl)-N-(4-methoxy-2-nitro-phenyl)pyridine-3-carboxamide

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-N-(4-methoxy-2-nitro-phenyl)pyridine-3-carboxamide Openeye Name: 2-(1,3-benzothiazol-2-yl)-N-(4-methoxy-2-nitro-phenyl)pyridine-3-carboxamide CAS Name: 2-(1,3-benzothiazol-2-yl)-N-(4-methoxy-2-nitrophenyl)-3-pyridinecarboxamide IUPAC Name: 2-(1,3-benzothiazol-2-yl)-N-(4-methoxy-2-nitrophenyl)pyridine-3-carboxamide Traditional Name: 2-(1,3-benzothiazol-2-yl)-N-(4-methoxy-2-nitro-phenyl)nicotinamide Formula: C20H14N4O4S MolecularWeight: 406.41456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC(=O)C2=C(N=CC=C2)C3=NC4=CC=CC=C4S3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)NC(=O)C2=C(N=CC=C2)C3=NC4=CC=CC=C4S3)[N+](=O)[O-]

InChI

InChI=1S/C20H14N4O4S/c1-28-12-8-9-14(16(11-12)24(26)27)22-19(25)13-5-4-10-21-18(13)20-23-15-6-2-3-7-17(15)29-20/h2-11H,1H3,(H,22,25)