ethyl N-[2-[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]carbamate

Systemtic Name: ethyl N-[2-[7-chloranyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]carbamate Openeye Name: ethyl N-[2-[7-chloro-3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]carbamate CAS Name: N-[2-[[7-chloro-3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[2-[7-chloro-3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]carbamate Traditional Name: N-[2-[[7-chloro-4-keto-3-(m-tolyl)quinazolin-2-yl]thio]acetyl]carbamic acid ethyl ester Formula: C20H18ClN3O4S MolecularWeight: 431.89262

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC=CC(=C3)C

InChI

InChI=1S/C20H18ClN3O4S/c1-3-28-20(27)23-17(25)11-29-19-22-16-10-13(21)7-8-15(16)18(26)24(19)14-6-4-5-12(2)9-14/h4-10H,3,11H2,1-2H3,(H,23,25,27)