(2,4-dimethylpyridin-3-yl)-[4-(3,3-diphenylpropyl)piperazin-1-yl]methanone

Systemtic Name: (2,4-dimethylpyridin-3-yl)-[4-(3,3-diphenylpropyl)piperazin-1-yl]methanone Openeye Name: (2,4-dimethyl-3-pyridyl)-[4-(3,3-diphenylpropyl)piperazin-1-yl]methanone CAS Name: (2,4-dimethyl-3-pyridinyl)-[4-(3,3-diphenylpropyl)-1-piperazinyl]methanone IUPAC Name: (2,4-dimethylpyridin-3-yl)-[4-(3,3-diphenylpropyl)piperazin-1-yl]methanone Traditional Name: (2,4-dimethyl-3-pyridyl)-[4-(3,3-diphenylpropyl)piperazino]methanone Formula: C27H31N3O MolecularWeight: 413.55454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC=C1)C)C(=O)N2CCN(CC2)CCC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NC=C1)C)C(=O)N2CCN(CC2)CCC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H31N3O/c1-21-13-15-28-22(2)26(21)27(31)30-19-17-29(18-20-30)16-14-25(23-9-5-3-6-10-23)24-11-7-4-8-12-24/h3-13,15,25H,14,16-20H2,1-2H3