[4-[(2-bromophenyl)methyl]-3-methyl-piperazin-1-yl]-[1-(pyridin-4-ylmethyl)piperidin-4-yl]methanone

Systemtic Name: [4-[(2-bromophenyl)methyl]-3-methyl-piperazin-1-yl]-[1-(pyridin-4-ylmethyl)piperidin-4-yl]methanone Openeye Name: [4-[(2-bromophenyl)methyl]-3-methyl-piperazin-1-yl]-[1-(4-pyridylmethyl)-4-piperidyl]methanone CAS Name: [4-[(2-bromophenyl)methyl]-3-methyl-1-piperazinyl]-[1-(pyridin-4-ylmethyl)-4-piperidinyl]methanone IUPAC Name: [4-[(2-bromophenyl)methyl]-3-methylpiperazin-1-yl]-[1-(pyridin-4-ylmethyl)piperidin-4-yl]methanone Traditional Name: [4-(2-bromobenzyl)-3-methyl-piperazino]-[1-(4-pyridylmethyl)-4-piperidyl]methanone Formula: C24H31BrN4O MolecularWeight: 471.43314

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC2=CC=CC=C2Br)C(=O)C3CCN(CC3)CC4=CC=NC=C4

Isomeric SMILES

CC1CN(CCN1CC2=CC=CC=C2Br)C(=O)C3CCN(CC3)CC4=CC=NC=C4

InChI

InChI=1S/C24H31BrN4O/c1-19-16-29(15-14-28(19)18-22-4-2-3-5-23(22)25)24(30)21-8-12-27(13-9-21)17-20-6-10-26-11-7-20/h2-7,10-11,19,21H,8-9,12-18H2,1H3