3-(2,4-dimethoxyphenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate

Systemtic Name: 3-(2,4-dimethoxyphenyl)carbonyl-2-sulfanylidene-quinazolin-4-olate Openeye Name: 3-(2,4-dimethoxybenzoyl)-2-thioxo-quinazolin-4-olate CAS Name: 3-[(2,4-dimethoxyphenyl)-oxomethyl]-2-sulfanylidene-4-quinazolinolate IUPAC Name: 3-(2,4-dimethoxybenzoyl)-2-sulfanylidenequinazolin-4-olate Traditional Name: 3-(2,4-dimethoxybenzoyl)-2-thioxo-quinazolin-4-olate Formula: C17H13N2O4S- MolecularWeight: 341.36112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2C(=C3C=CC=CC3=NC2=S)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2C(=C3C=CC=CC3=NC2=S)[O-])OC

InChI

InChI=1S/C17H14N2O4S/c1-22-10-7-8-12(14(9-10)23-2)16(21)19-15(20)11-5-3-4-6-13(11)18-17(19)24/h3-9,20H,1-2H3/p-1