2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-methyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-N-methyl-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: 2-[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]-N-methyl-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanyl-N-methylacetamide Traditional Name: N-benzyl-2-[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N(C)CC3=CC=CC=C3

Isomeric SMILES

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC(=O)N(C)CC3=CC=CC=C3

InChI

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