1-[(3-fluorophenyl)methyl]-N-(6-nitro-1,3-benzothiazol-2-yl)-2-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 1-[(3-fluorophenyl)methyl]-N-(6-nitro-1,3-benzothiazol-2-yl)-2-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-[(3-fluorophenyl)methyl]-N-(6-nitro-1,3-benzothiazol-2-yl)-2-oxo-pyridine-3-carboxamide CAS Name: 1-[(3-fluorophenyl)methyl]-N-(6-nitro-1,3-benzothiazol-2-yl)-2-oxo-3-pyridinecarboxamide IUPAC Name: 1-[(3-fluorophenyl)methyl]-N-(6-nitro-1,3-benzothiazol-2-yl)-2-oxopyridine-3-carboxamide Traditional Name: 1-(3-fluorobenzyl)-2-keto-N-(6-nitro-1,3-benzothiazol-2-yl)nicotinamide Formula: C20H13FN4O4S MolecularWeight: 424.405023

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H13FN4O4S/c21-13-4-1-3-12(9-13)11-24-8-2-5-15(19(24)27)18(26)23-20-22-16-7-6-14(25(28)29)10-17(16)30-20/h1-10H,11H2,(H,22,23,26)