7-methoxycarbonyl-3-[2-(4-methylphenyl)sulfanylethyl]-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-methoxycarbonyl-3-[2-(4-methylphenyl)sulfanylethyl]-2-sulfanylidene-quinazolin-4-olate Openeye Name: 7-methoxycarbonyl-3-[2-(p-tolylsulfanyl)ethyl]-2-thioxo-quinazolin-4-olate CAS Name: 7-methoxycarbonyl-3-[2-[(4-methylphenyl)thio]ethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-methoxycarbonyl-3-[2-(4-methylphenyl)sulfanylethyl]-2-sulfanylidenequinazolin-4-olate Traditional Name: 7-carbomethoxy-3-[2-(p-tolylthio)ethyl]-2-thioxo-quinazolin-4-olate Formula: C19H17N2O3S2- MolecularWeight: 385.47988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCN2C(=C3C=CC(=CC3=NC2=S)C(=O)OC)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)SCCN2C(=C3C=CC(=CC3=NC2=S)C(=O)OC)[O-]

InChI

InChI=1S/C19H18N2O3S2/c1-12-3-6-14(7-4-12)26-10-9-21-17(22)15-8-5-13(18(23)24-2)11-16(15)20-19(21)25/h3-8,11,22H,9-10H2,1-2H3/p-1