7-[(2-methylsulfanylphenyl)carbamoyl]-3-phenyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 7-[(2-methylsulfanylphenyl)carbamoyl]-3-phenyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 7-[(2-methylsulfanylphenyl)carbamoyl]-3-phenyl-2-thioxo-quinazolin-4-olate CAS Name: 7-[[2-(methylthio)anilino]-oxomethyl]-3-phenyl-2-sulfanylidene-4-quinazolinolate IUPAC Name: 7-[(2-methylsulfanylphenyl)carbamoyl]-3-phenyl-2-sulfanylidenequinazolin-4-olate Traditional Name: 7-[[2-(methylthio)phenyl]carbamoyl]-3-phenyl-2-thioxo-quinazolin-4-olate Formula: C22H16N3O2S2- MolecularWeight: 418.51134

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1NC(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])C4=CC=CC=C4

Isomeric SMILES

CSC1=CC=CC=C1NC(=O)C2=CC3=NC(=S)N(C(=C3C=C2)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H17N3O2S2/c1-29-19-10-6-5-9-17(19)23-20(26)14-11-12-16-18(13-14)24-22(28)25(21(16)27)15-7-3-2-4-8-15/h2-13,27H,1H3,(H,23,26)/p-1