2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)propan-1-one

Systemtic Name: 2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]-1-(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)propan-1-one Openeye Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(benzothiophen-3-ylmethyl)piperazin-1-yl]propan-1-one CAS Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(1-benzothiophen-3-ylmethyl)-1-piperazinyl]-1-propanone IUPAC Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(1-benzothiophen-3-ylmethyl)piperazin-1-yl]propan-1-one Traditional Name: 1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[4-(benzothiophen-3-ylmethyl)piperazino]propan-1-one Formula: C24H29N3O2S MolecularWeight: 423.57096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)C)C)C(=O)C(C)N2CCN(CC2)CC3=CSC4=CC=CC=C43

Isomeric SMILES

CC1=C(NC(=C1C(=O)C)C)C(=O)C(C)N2CCN(CC2)CC3=CSC4=CC=CC=C43

InChI

InChI=1S/C24H29N3O2S/c1-15-22(18(4)28)16(2)25-23(15)24(29)17(3)27-11-9-26(10-12-27)13-19-14-30-21-8-6-5-7-20(19)21/h5-8,14,17,25H,9-13H2,1-4H3