N-[(4-bromophenyl)methyl]-N-methyl-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(4-bromophenyl)methyl]-N-methyl-2-(4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(4-bromophenyl)methyl]-2-(3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: N-[(4-bromophenyl)methyl]-N-methyl-2-[(4-oxo-3-propan-2-yl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(4-bromophenyl)methyl]-N-methyl-2-(4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylacetamide Traditional Name: N-(4-bromobenzyl)-2-[(3-isopropyl-4-keto-quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C21H22BrN3O2S MolecularWeight: 460.38728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CC3=CC=C(C=C3)Br

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(C)CC3=CC=C(C=C3)Br

InChI

InChI=1S/C21H22BrN3O2S/c1-14(2)25-20(27)17-6-4-5-7-18(17)23-21(25)28-13-19(26)24(3)12-15-8-10-16(22)11-9-15/h4-11,14H,12-13H2,1-3H3