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

Systemtic Name: 1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[4-(2-methylphenyl)piperazin-1-yl]ethanone Openeye Name: 1-[2,5-dimethyl-1-(2-thienylmethyl)pyrrol-3-yl]-2-[4-(o-tolyl)piperazin-1-yl]ethanone CAS Name: 1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolyl]-2-[4-(2-methylphenyl)-1-piperazinyl]ethanone IUPAC Name: 1-[2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrol-3-yl]-2-[4-(2-methylphenyl)piperazin-1-yl]ethanone Traditional Name: 1-[2,5-dimethyl-1-(2-thenyl)pyrrol-3-yl]-2-[4-(o-tolyl)piperazino]ethanone Formula: C24H29N3OS MolecularWeight: 407.57156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)CC(=O)C3=C(N(C(=C3)C)CC4=CC=CS4)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)CC(=O)C3=C(N(C(=C3)C)CC4=CC=CS4)C

InChI

InChI=1S/C24H29N3OS/c1-18-7-4-5-9-23(18)26-12-10-25(11-13-26)17-24(28)22-15-19(2)27(20(22)3)16-21-8-6-14-29-21/h4-9,14-15H,10-13,16-17H2,1-3H3