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

Systemtic Name: 3-(2-methylphenyl)-2-sulfanylidene-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate Openeye Name: 3-(o-tolyl)-2-thioxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate CAS Name: 3-(2-methylphenyl)-2-sulfanylidene-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate IUPAC Name: 3-(2-methylphenyl)-2-sulfanylidene-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate Traditional Name: 3-(o-tolyl)-2-thioxo-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-olate Formula: C18H16N3OS- MolecularWeight: 322.40414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C3C=C4CCCCC4=NC3=NC2=S)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=C3C=C4CCCCC4=NC3=NC2=S)[O-]

InChI

InChI=1S/C18H17N3OS/c1-11-6-2-5-9-15(11)21-17(22)13-10-12-7-3-4-8-14(12)19-16(13)20-18(21)23/h2,5-6,9-10,22H,3-4,7-8H2,1H3/p-1