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

Systemtic Name: N-[(2-bromophenyl)methyl]-N-methyl-2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(2-bromophenyl)methyl]-N-methyl-acetamide CAS Name: N-[(2-bromophenyl)methyl]-N-methyl-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]acetamide IUPAC Name: N-[(2-bromophenyl)methyl]-N-methyl-2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-allyl-4-keto-quinazolin-2-yl)thio]-N-(2-bromobenzyl)-N-methyl-acetamide Formula: C21H20BrN3O2S MolecularWeight: 458.3714

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CN(CC1=CC=CC=C1Br)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C21H20BrN3O2S/c1-3-12-25-20(27)16-9-5-7-11-18(16)23-21(25)28-14-19(26)24(2)13-15-8-4-6-10-17(15)22/h3-11H,1,12-14H2,2H3