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

Systemtic Name: N-[(4-bromophenyl)methyl]-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-methyl-ethanamide Openeye Name: N-[(4-bromophenyl)methyl]-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-methyl-acetamide CAS Name: N-[(4-bromophenyl)methyl]-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-methylacetamide IUPAC Name: N-[(4-bromophenyl)methyl]-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-methylacetamide Traditional Name: N-(4-bromobenzyl)-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-methyl-acetamide Formula: C23H24BrN3O2S MolecularWeight: 486.42456

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Br)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

Isomeric SMILES

CN(CC1=CC=C(C=C1)Br)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4

InChI

InChI=1S/C23H24BrN3O2S/c1-26(14-16-10-12-17(24)13-11-16)21(28)15-30-23-25-20-9-5-4-8-19(20)22(29)27(23)18-6-2-3-7-18/h4-5,8-13,18H,2-3,6-7,14-15H2,1H3