1-(3-methoxyphenyl)-4-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]piperazine

Systemtic Name: 1-(3-methoxyphenyl)-4-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]piperazine Openeye Name: 1-(3-methoxyphenyl)-4-[[1-(p-tolylsulfonyl)pyrrol-2-yl]methyl]piperazine CAS Name: 1-(3-methoxyphenyl)-4-[[1-(4-methylphenyl)sulfonyl-2-pyrrolyl]methyl]piperazine IUPAC Name: 1-(3-methoxyphenyl)-4-[[1-(4-methylphenyl)sulfonylpyrrol-2-yl]methyl]piperazine Traditional Name: 1-(3-methoxyphenyl)-4-[(1-tosylpyrrol-2-yl)methyl]piperazine Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2CN3CCN(CC3)C4=CC(=CC=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC=C2CN3CCN(CC3)C4=CC(=CC=C4)OC

InChI

InChI=1S/C23H27N3O3S/c1-19-8-10-23(11-9-19)30(27,28)26-12-4-6-21(26)18-24-13-15-25(16-14-24)20-5-3-7-22(17-20)29-2/h3-12,17H,13-16,18H2,1-2H3