2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone

Systemtic Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone Openeye Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone CAS Name: 2-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone IUPAC Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone Traditional Name: 2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-1-(2,5-dimethyl-1H-pyrrol-3-yl)ethanone Formula: C20H27N3O5S MolecularWeight: 421.51048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1)C)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=CC(=C(N1)C)C(=O)CN2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H27N3O5S/c1-14-11-17(15(2)21-14)18(24)13-22-7-9-23(10-8-22)29(25,26)16-5-6-19(27-3)20(12-16)28-4/h5-6,11-12,21H,7-10,13H2,1-4H3