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

Systemtic Name: N-(4-bromophenyl)-2-[3-(4-butylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(4-bromophenyl)-2-[3-(4-butylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-(4-bromophenyl)-2-[[3-(4-butylphenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(4-bromophenyl)-2-[3-(4-butylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(4-bromophenyl)-2-[[3-(4-butylphenyl)-4-keto-quinazolin-2-yl]thio]acetamide Formula: C26H24BrN3O2S MolecularWeight: 522.45666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C26H24BrN3O2S/c1-2-3-6-18-9-15-21(16-10-18)30-25(32)22-7-4-5-8-23(22)29-26(30)33-17-24(31)28-20-13-11-19(27)12-14-20/h4-5,7-16H,2-3,6,17H2,1H3,(H,28,31)