3-(4-bromophenyl)-2-[1-[3-methyl-4-(2-methylphenyl)carbonyl-piperazin-1-yl]propyl]quinazolin-4-one

Systemtic Name: 3-(4-bromophenyl)-2-[1-[3-methyl-4-(2-methylphenyl)carbonyl-piperazin-1-yl]propyl]quinazolin-4-one Openeye Name: 3-(4-bromophenyl)-2-[1-[3-methyl-4-(2-methylbenzoyl)piperazin-1-yl]propyl]quinazolin-4-one CAS Name: 3-(4-bromophenyl)-2-[1-[3-methyl-4-[(2-methylphenyl)-oxomethyl]-1-piperazinyl]propyl]-4-quinazolinone IUPAC Name: 3-(4-bromophenyl)-2-[1-[3-methyl-4-(2-methylbenzoyl)piperazin-1-yl]propyl]quinazolin-4-one Traditional Name: 3-(4-bromophenyl)-2-[1-(3-methyl-4-o-toluoyl-piperazino)propyl]quinazolin-4-one Formula: C30H31BrN4O2 MolecularWeight: 559.49674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)N4CCN(C(C4)C)C(=O)C5=CC=CC=C5C

Isomeric SMILES

CCC(C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)Br)N4CCN(C(C4)C)C(=O)C5=CC=CC=C5C

InChI

InChI=1S/C30H31BrN4O2/c1-4-27(33-17-18-34(21(3)19-33)29(36)24-10-6-5-9-20(24)2)28-32-26-12-8-7-11-25(26)30(37)35(28)23-15-13-22(31)14-16-23/h5-16,21,27H,4,17-19H2,1-3H3