2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-1-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 2-[2-(4-methoxyphenyl)-1-pyrrolidinyl]-1-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-1-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[2-(4-methoxyphenyl)pyrrolidino]-1-[4-(2-thenoyl)piperazino]ethanone Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2CC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C22H27N3O3S/c1-28-18-8-6-17(7-9-18)19-4-2-10-25(19)16-21(26)23-11-13-24(14-12-23)22(27)20-5-3-15-29-20/h3,5-9,15,19H,2,4,10-14,16H2,1H3