2-[(diphenylmethyl)amino]-1-[4-[1-(2-methylpyridin-3-yl)prop-2-ynyl]piperazin-1-yl]ethanone

Systemtic Name: 2-[(diphenylmethyl)amino]-1-[4-[1-(2-methylpyridin-3-yl)prop-2-ynyl]piperazin-1-yl]ethanone Openeye Name: 2-(benzhydrylamino)-1-[4-[1-(2-methyl-3-pyridyl)prop-2-ynyl]piperazin-1-yl]ethanone CAS Name: 2-[(diphenylmethyl)amino]-1-[4-[1-(2-methyl-3-pyridinyl)prop-2-ynyl]-1-piperazinyl]ethanone IUPAC Name: 2-(benzhydrylamino)-1-[4-[1-(2-methylpyridin-3-yl)prop-2-ynyl]piperazin-1-yl]ethanone Traditional Name: 2-(benzhydrylamino)-1-[4-[1-(2-methyl-3-pyridyl)prop-2-ynyl]piperazino]ethanone Formula: C28H30N4O MolecularWeight: 438.564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=N1)C(C#C)N2CCN(CC2)C(=O)CNC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC=N1)C(C#C)N2CCN(CC2)C(=O)CNC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C28H30N4O/c1-3-26(25-15-10-16-29-22(25)2)31-17-19-32(20-18-31)27(33)21-30-28(23-11-6-4-7-12-23)24-13-8-5-9-14-24/h1,4-16,26,28,30H,17-21H2,2H3