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

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: N-(4-chlorobenzyl)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionamide Formula: C19H18ClN3O2S MolecularWeight: 387.88312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)Cl)SC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CC(C(=O)NCC1=CC=C(C=C1)Cl)SC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C19H18ClN3O2S/c1-12(17(24)21-11-13-7-9-14(20)10-8-13)26-19-22-16-6-4-3-5-15(16)18(25)23(19)2/h3-10,12H,11H2,1-2H3,(H,21,24)