[3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-[2-(pyridin-4-ylmethylamino)ethyl]piperazin-1-yl]methanone

Systemtic Name: [3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-[2-(pyridin-4-ylmethylamino)ethyl]piperazin-1-yl]methanone Openeye Name: [3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-[2-(4-pyridylmethylamino)ethyl]piperazin-1-yl]methanone CAS Name: [3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-[2-(pyridin-4-ylmethylamino)ethyl]-1-piperazinyl]methanone IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]-[2-[(3,4-dimethylphenyl)methyl]-4-[2-(pyridin-4-ylmethylamino)ethyl]piperazin-1-yl]methanone Traditional Name: [3,5-bis(trifluoromethyl)phenyl]-[2-(3,4-dimethylbenzyl)-4-[2-(4-pyridylmethylamino)ethyl]piperazino]methanone Formula: C30H32F6N4O MolecularWeight: 578.591699

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CC2CN(CCN2C(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)CCNCC4=CC=NC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)CC2CN(CCN2C(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)CCNCC4=CC=NC=C4)C

InChI

InChI=1S/C30H32F6N4O/c1-20-3-4-23(13-21(20)2)14-27-19-39(10-9-38-18-22-5-7-37-8-6-22)11-12-40(27)28(41)24-15-25(29(31,32)33)17-26(16-24)30(34,35)36/h3-8,13,15-17,27,38H,9-12,14,18-19H2,1-2H3