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

Systemtic Name: 2-(2-butylsulfanylethyl)-7-chloranyl-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione Openeye Name: 2-(2-butylsulfanylethyl)-7-chloro-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione CAS Name: 2-[2-(butylthio)ethyl]-7-chloro-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione IUPAC Name: 2-(2-butylsulfanylethyl)-7-chloro-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione Traditional Name: 2-[2-(butylthio)ethyl]-7-chloro-3,5-dihydropyridazino[4,5-b]quinoline-1,4,10-trione Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCN1C(=O)C2=C(C(=O)N1)NC3=C(C2=O)C=CC(=C3)Cl

Isomeric SMILES

CCCCSCCN1C(=O)C2=C(C(=O)N1)NC3=C(C2=O)C=CC(=C3)Cl

InChI

InChI=1S/C17H18ClN3O3S/c1-2-3-7-25-8-6-21-17(24)13-14(16(23)20-21)19-12-9-10(18)4-5-11(12)15(13)22/h4-5,9H,2-3,6-8H2,1H3,(H,19,22)(H,20,23)