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

Systemtic Name: 5-[(2-bromophenyl)carbonylamino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Openeye Name: 5-[(2-bromobenzoyl)amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide CAS Name: 5-[[(2-bromophenyl)-oxomethyl]amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)-1-piperazinyl]benzamide IUPAC Name: 5-[(2-bromobenzoyl)amino]-N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: 5-[(2-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=C4Br)C(=O)NC5CCCCC5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=C4Br)C(=O)NC5CCCCC5

InChI

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