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

Systemtic Name: 4-azanyl-5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2-sulfanylidene-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one Openeye Name: 4-amino-5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2-thioxo-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one CAS Name: 4-amino-5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2-sulfanylidene-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one IUPAC Name: 4-amino-5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2-sulfanylidene-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one Traditional Name: 4-amino-5-(1,3-benzodioxol-5-yl)-8,8-dimethyl-2-thioxo-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(NC(=S)N=C3N2)N)C4=CC5=C(C=C4)OCO5)C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(NC(=S)N=C3N2)N)C4=CC5=C(C=C4)OCO5)C(=O)C1)C

InChI

InChI=1S/C20H20N4O3S/c1-20(2)6-10-15(11(25)7-20)14(9-3-4-12-13(5-9)27-8-26-12)16-17(21)23-19(28)24-18(16)22-10/h3-5,14H,6-8H2,1-2H3,(H4,21,22,23,24,28)