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

Systemtic Name: 4-azanyl-8,8-dimethyl-5-(2-nitrophenyl)-2-sulfanylidene-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one Openeye Name: 4-amino-8,8-dimethyl-5-(2-nitrophenyl)-2-thioxo-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one CAS Name: 4-amino-8,8-dimethyl-5-(2-nitrophenyl)-2-sulfanylidene-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one IUPAC Name: 4-amino-8,8-dimethyl-5-(2-nitrophenyl)-2-sulfanylidene-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one Traditional Name: 4-amino-8,8-dimethyl-5-(2-nitrophenyl)-2-thioxo-5,7,9,10-tetrahydro-3H-pyrimido[4,5-b]quinolin-6-one Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(C3=C(NC(=S)N=C3N2)N)C4=CC=CC=C4[N+](=O)[O-])C(=O)C1)C

Isomeric SMILES

CC1(CC2=C(C(C3=C(NC(=S)N=C3N2)N)C4=CC=CC=C4[N+](=O)[O-])C(=O)C1)C

InChI

InChI=1S/C19H19N5O3S/c1-19(2)7-10-14(12(25)8-19)13(9-5-3-4-6-11(9)24(26)27)15-16(20)22-18(28)23-17(15)21-10/h3-6,13H,7-8H2,1-2H3,(H4,20,21,22,23,28)