2-[1-[(3,4-dichlorophenyl)methyl]-5-ethyl-2-oxidanylidene-4-sulfanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: 2-[1-[(3,4-dichlorophenyl)methyl]-5-ethyl-2-oxidanylidene-4-sulfanylidene-quinazolin-3-yl]ethanoate Openeye Name: 2-[1-[(3,4-dichlorophenyl)methyl]-5-ethyl-2-oxo-4-thioxo-quinazolin-3-yl]acetate CAS Name: 2-[1-[(3,4-dichlorophenyl)methyl]-5-ethyl-2-oxo-4-sulfanylidene-3-quinazolinyl]acetate IUPAC Name: 2-[1-[(3,4-dichlorophenyl)methyl]-5-ethyl-2-oxo-4-sulfanylidenequinazolin-3-yl]acetate Traditional Name: 2-[1-(3,4-dichlorobenzyl)-5-ethyl-2-keto-4-thioxo-quinazolin-3-yl]acetate Formula: C19H15Cl2N2O3S- MolecularWeight: 422.305

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)N(C(=O)N(C2=S)CC(=O)[O-])CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCC1=C2C(=CC=C1)N(C(=O)N(C2=S)CC(=O)[O-])CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C19H16Cl2N2O3S/c1-2-12-4-3-5-15-17(12)18(27)23(10-16(24)25)19(26)22(15)9-11-6-7-13(20)14(21)8-11/h3-8H,2,9-10H2,1H3,(H,24,25)/p-1