N-(4-bromophenyl)-2-[[5-ethyl-5-methyl-4-oxidanylidene-3-(phenylmethyl)-6H-benzo[h]quinazolin-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[[5-ethyl-5-methyl-4-oxidanylidene-3-(phenylmethyl)-6H-benzo[h]quinazolin-2-yl]sulfanyl]ethanamide Openeye Name: 2-[(3-benzyl-5-ethyl-5-methyl-4-oxo-6H-benzo[h]quinazolin-2-yl)sulfanyl]-N-(4-bromophenyl)acetamide CAS Name: N-(4-bromophenyl)-2-[[5-ethyl-5-methyl-4-oxo-3-(phenylmethyl)-6H-benzo[h]quinazolin-2-yl]thio]acetamide IUPAC Name: 2-[(3-benzyl-5-ethyl-5-methyl-4-oxo-6H-benzo[h]quinazolin-2-yl)sulfanyl]-N-(4-bromophenyl)acetamide Traditional Name: 2-[(3-benzyl-5-ethyl-4-keto-5-methyl-6H-benzo[h]quinazolin-2-yl)thio]-N-(4-bromophenyl)acetamide Formula: C30H28BrN3O2S MolecularWeight: 574.53122

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC(=O)NC4=CC=C(C=C4)Br)CC5=CC=CC=C5)C

Isomeric SMILES

CCC1(CC2=CC=CC=C2C3=C1C(=O)N(C(=N3)SCC(=O)NC4=CC=C(C=C4)Br)CC5=CC=CC=C5)C

InChI

InChI=1S/C30H28BrN3O2S/c1-3-30(2)17-21-11-7-8-12-24(21)27-26(30)28(36)34(18-20-9-5-4-6-10-20)29(33-27)37-19-25(35)32-23-15-13-22(31)14-16-23/h4-16H,3,17-19H2,1-2H3,(H,32,35)