1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanone

Systemtic Name: 1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanone Openeye Name: 1-[2,5-dimethyl-1-(2-thienylmethyl)pyrrol-3-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanone CAS Name: 1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolyl]-2-[4-(3-methoxyphenyl)-1-piperazinyl]ethanone IUPAC Name: 1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[4-(3-methoxyphenyl)piperazin-1-yl]ethanone Traditional Name: 1-[2,5-dimethyl-1-(2-thenyl)pyrrol-3-yl]-2-[4-(3-methoxyphenyl)piperazino]ethanone Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CS2)C)C(=O)CN3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CS2)C)C(=O)CN3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C24H29N3O2S/c1-18-14-23(19(2)27(18)16-22-8-5-13-30-22)24(28)17-25-9-11-26(12-10-25)20-6-4-7-21(15-20)29-3/h4-8,13-15H,9-12,16-17H2,1-3H3