(2R)-1-(1H-indol-3-yl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one

Systemtic Name: (2R)-1-(1H-indol-3-yl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one Openeye Name: (2R)-1-(1H-indol-3-yl)-2-[4-(p-tolylsulfonyl)piperazin-1-yl]propan-1-one CAS Name: (2R)-1-(1H-indol-3-yl)-2-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-1-propanone IUPAC Name: (2R)-1-(1H-indol-3-yl)-2-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]propan-1-one Traditional Name: (2R)-1-(1H-indol-3-yl)-2-(4-tosylpiperazino)propan-1-one Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)[C@H](C)C(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H25N3O3S/c1-16-7-9-18(10-8-16)29(27,28)25-13-11-24(12-14-25)17(2)22(26)20-15-23-21-6-4-3-5-19(20)21/h3-10,15,17,23H,11-14H2,1-2H3/t17-/m1/s1