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

Systemtic Name: N-[(3-chlorophenyl)methyl]-2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(3-chlorophenyl)methyl]-2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(3-chlorophenyl)methyl]-2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(3-chlorophenyl)methyl]-2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(3-chlorobenzyl)-2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]acetamide Formula: C20H18ClN3O2S MolecularWeight: 399.89382

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CC1N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H18ClN3O2S/c21-14-5-3-4-13(10-14)11-22-18(25)12-27-20-23-17-7-2-1-6-16(17)19(26)24(20)15-8-9-15/h1-7,10,15H,8-9,11-12H2,(H,22,25)