7-chloranyl-2-(4-methylsulfanylphenyl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione

Systemtic Name: 7-chloranyl-2-(4-methylsulfanylphenyl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione Openeye Name: 7-chloro-2-(4-methylsulfanylphenyl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione CAS Name: 7-chloro-2-[4-(methylthio)phenyl]-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione IUPAC Name: 7-chloro-2-(4-methylsulfanylphenyl)-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione Traditional Name: 7-chloro-2-[4-(methylthio)phenyl]-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione Formula: C18H12ClN3O3S MolecularWeight: 385.82418

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)N2C(=O)C3=C(C(=O)N2)NC4=C(C3=O)C=CC(=C4)Cl

Isomeric SMILES

CSC1=CC=C(C=C1)N2C(=O)C3=C(C(=O)N2)NC4=C(C3=O)C=CC(=C4)Cl

InChI

InChI=1S/C18H12ClN3O3S/c1-26-11-5-3-10(4-6-11)22-18(25)14-15(17(24)21-22)20-13-8-9(19)2-7-12(13)16(14)23/h2-8H,1H3,(H,20,23)(H,21,24)