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

Systemtic Name: 4-azanyl-5-(3-nitrophenyl)-2-sulfanylidene-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one Openeye Name: 4-amino-5-(3-nitrophenyl)-2-thioxo-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one CAS Name: 4-amino-5-(3-nitrophenyl)-2-sulfanylidene-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one IUPAC Name: 4-amino-5-(3-nitrophenyl)-2-sulfanylidene-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one Traditional Name: 4-amino-5-(3-nitrophenyl)-2-thioxo-3,5,7,8,9,10-hexahydropyrimido[4,5-b]quinolin-6-one Formula: C17H15N5O3S MolecularWeight: 369.3977

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(C3=C(NC(=S)N=C3N2)N)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C1

Isomeric SMILES

C1CC2=C(C(C3=C(NC(=S)N=C3N2)N)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)C1

InChI

InChI=1S/C17H15N5O3S/c18-15-14-12(8-3-1-4-9(7-8)22(24)25)13-10(5-2-6-11(13)23)19-16(14)21-17(26)20-15/h1,3-4,7,12H,2,5-6H2,(H4,18,19,20,21,26)