N-[(3-chlorophenyl)methyl]-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-2-[3-(4-ethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-[(3-chlorophenyl)methyl]-2-[3-(4-ethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[(3-chlorophenyl)methyl]-2-[[3-(4-ethylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(3-chlorophenyl)methyl]-2-[3-(4-ethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(3-chlorobenzyl)-2-[[3-(4-ethylphenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C25H22ClN3O2S MolecularWeight: 463.97908

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC(=CC=C4)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C25H22ClN3O2S/c1-2-17-10-12-20(13-11-17)29-24(31)21-8-3-4-9-22(21)28-25(29)32-16-23(30)27-15-18-6-5-7-19(26)14-18/h3-14H,2,15-16H2,1H3,(H,27,30)