2-(1,3-benzothiazol-2-yl)-N-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carboxamide

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-N-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carboxamide Openeye Name: 2-(1,3-benzothiazol-2-yl)-N-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carboxamide CAS Name: 2-(1,3-benzothiazol-2-yl)-N-(6-nitro-1,3-benzodioxol-5-yl)-3-pyridinecarboxamide IUPAC Name: 2-(1,3-benzothiazol-2-yl)-N-(6-nitro-1,3-benzodioxol-5-yl)pyridine-3-carboxamide Traditional Name: 2-(1,3-benzothiazol-2-yl)-N-(6-nitro-1,3-benzodioxol-5-yl)nicotinamide Formula: C20H12N4O5S MolecularWeight: 420.39808

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)NC(=O)C3=C(N=CC=C3)C4=NC5=CC=CC=C5S4)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)NC(=O)C3=C(N=CC=C3)C4=NC5=CC=CC=C5S4)[N+](=O)[O-]

InChI

InChI=1S/C20H12N4O5S/c25-19(22-13-8-15-16(29-10-28-15)9-14(13)24(26)27)11-4-3-7-21-18(11)20-23-12-5-1-2-6-17(12)30-20/h1-9H,10H2,(H,22,25)