N-[(1R)-1-(3-chlorophenyl)ethyl]-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-(4-oxidanylidene-3-propyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-(4-oxo-3-propyl-quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-[(4-oxo-3-propyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-(4-oxo-3-propylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-[(1R)-1-(3-chlorophenyl)ethyl]-2-[(4-keto-3-propyl-quinazolin-2-yl)thio]acetamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC(C)C3=CC(=CC=C3)Cl

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N[C@H](C)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-3-11-25-20(27)17-9-4-5-10-18(17)24-21(25)28-13-19(26)23-14(2)15-7-6-8-16(22)12-15/h4-10,12,14H,3,11,13H2,1-2H3,(H,23,26)/t14-/m1/s1