N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-2-keto-1H-quinoline-4-carboxamide Formula: C20H13N3O4S MolecularWeight: 391.39992

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC(=O)NC5=CC=CC=C54

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CSC(=N3)NC(=O)C4=CC(=O)NC5=CC=CC=C54

InChI

InChI=1S/C20H13N3O4S/c24-18-8-13(12-3-1-2-4-14(12)21-18)19(25)23-20-22-15(9-28-20)11-5-6-16-17(7-11)27-10-26-16/h1-9H,10H2,(H,21,24)(H,22,23,25)