3-(3-chlorophenyl)-2-sulfanylidene-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate

Systemtic Name: 3-(3-chlorophenyl)-2-sulfanylidene-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate Openeye Name: 3-(3-chlorophenyl)-2-thioxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate CAS Name: 3-(3-chlorophenyl)-2-sulfanylidene-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate IUPAC Name: 3-(3-chlorophenyl)-2-sulfanylidene-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate Traditional Name: 3-(3-chlorophenyl)-2-thioxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate Formula: C17H13ClN3OS- MolecularWeight: 342.82262

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=NC(=S)N(C(=C3C=C2C1)[O-])C4=CC(=CC=C4)Cl

Isomeric SMILES

C1CCC2=NC3=NC(=S)N(C(=C3C=C2C1)[O-])C4=CC(=CC=C4)Cl

InChI

InChI=1S/C17H14ClN3OS/c18-11-5-3-6-12(9-11)21-16(22)13-8-10-4-1-2-7-14(10)19-15(13)20-17(21)23/h3,5-6,8-9,22H,1-2,4,7H2/p-1