5-[(4-bromophenyl)carbonylamino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide

Systemtic Name: 5-[(4-bromophenyl)carbonylamino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: 5-[(4-bromobenzoyl)amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide CAS Name: 5-[[(4-bromophenyl)-oxomethyl]amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: 5-[(4-bromobenzoyl)amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: 5-[(4-bromobenzoyl)amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C31H35BrN4O3 MolecularWeight: 591.5386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(C=C4)Br)C(=O)NC5CCCCC5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=C(C=C4)Br)C(=O)NC5CCCCC5

InChI

InChI=1S/C31H35BrN4O3/c1-39-29-10-6-5-9-28(29)36-19-17-35(18-20-36)27-16-15-25(34-30(37)22-11-13-23(32)14-12-22)21-26(27)31(38)33-24-7-3-2-4-8-24/h5-6,9-16,21,24H,2-4,7-8,17-20H2,1H3,(H,33,38)(H,34,37)