2-[4-[3-(4-methylphenyl)thiophen-2-yl]carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[3-(4-methylphenyl)thiophen-2-yl]carbonylpiperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[3-(p-tolyl)thiophene-2-carbonyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[[3-(4-methylphenyl)-2-thiophenyl]-oxomethyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[3-(4-methylphenyl)thiophene-2-carbonyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-[3-(p-tolyl)thiophene-2-carbonyl]piperazino]-1-pyrrolidino-ethanone Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(SC=C2)C(=O)N3CCN(CC3)CC(=O)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(SC=C2)C(=O)N3CCN(CC3)CC(=O)N4CCCC4

InChI

InChI=1S/C22H27N3O2S/c1-17-4-6-18(7-5-17)19-8-15-28-21(19)22(27)25-13-11-23(12-14-25)16-20(26)24-9-2-3-10-24/h4-8,15H,2-3,9-14,16H2,1H3