5-[(3-bromophenyl)carbonylamino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide

Systemtic Name: 5-[(3-bromophenyl)carbonylamino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: 5-[(3-bromobenzoyl)amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide CAS Name: 5-[[(3-bromophenyl)-oxomethyl]amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: 5-[(3-bromobenzoyl)amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: 5-[(3-bromobenzoyl)amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C31H35BrN4O3 MolecularWeight: 591.5386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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