4-azanyl-5-(1,3-benzodioxol-5-yl)-2-sulfanylidene-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one

Systemtic Name: 4-azanyl-5-(1,3-benzodioxol-5-yl)-2-sulfanylidene-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one Openeye Name: 4-amino-5-(1,3-benzodioxol-5-yl)-2-thioxo-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one CAS Name: 4-amino-5-(1,3-benzodioxol-5-yl)-2-sulfanylidene-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one IUPAC Name: 4-amino-5-(1,3-benzodioxol-5-yl)-2-sulfanylidene-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one Traditional Name: 4-amino-5-(1,3-benzodioxol-5-yl)-2-thioxo-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one Formula: C18H16N4O3S MolecularWeight: 368.40964

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C3=C(NC(=S)N=C3N2)N)C4=CC5=C(C=C4)OCO5)C(=O)C1

Isomeric SMILES

C1CC2=C(C(C3=C(NC(=S)N=C3N2)N)C4=CC5=C(C=C4)OCO5)C(=O)C1

InChI

InChI=1S/C18H16N4O3S/c19-16-15-13(8-4-5-11-12(6-8)25-7-24-11)14-9(2-1-3-10(14)23)20-17(15)22-18(26)21-16/h4-6,13H,1-3,7H2,(H4,19,20,21,22,26)