2-[[(4-methylphenyl)-thiophen-2-yl-methyl]amino]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[(4-methylphenyl)-thiophen-2-yl-methyl]amino]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[[p-tolyl(2-thienyl)methyl]amino]-1-[4-(2-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-[[(4-methylphenyl)-thiophen-2-ylmethyl]amino]-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[[(4-methylphenyl)-thiophen-2-ylmethyl]amino]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[[p-tolyl(2-thienyl)methyl]amino]-1-[4-(2-pyridyl)piperazino]ethanone Formula: C23H26N4OS MolecularWeight: 406.54374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)N3CCN(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CS2)NCC(=O)N3CCN(CC3)C4=CC=CC=N4

InChI

InChI=1S/C23H26N4OS/c1-18-7-9-19(10-8-18)23(20-5-4-16-29-20)25-17-22(28)27-14-12-26(13-15-27)21-6-2-3-11-24-21/h2-11,16,23,25H,12-15,17H2,1H3