[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-methyl-1H-indol-3-yl)methanone

Systemtic Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-methyl-1H-indol-3-yl)methanone Openeye Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-methyl-1H-indol-3-yl)methanone CAS Name: [4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-(2-methyl-1H-indol-3-yl)methanone IUPAC Name: [4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]-(2-methyl-1H-indol-3-yl)methanone Traditional Name: [4-(2,5-dimethylphenyl)sulfonylpiperazino]-(2-methyl-1H-indol-3-yl)methanone Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(NC4=CC=CC=C43)C

InChI

InChI=1S/C22H25N3O3S/c1-15-8-9-16(2)20(14-15)29(27,28)25-12-10-24(11-13-25)22(26)21-17(3)23-19-7-5-4-6-18(19)21/h4-9,14,23H,10-13H2,1-3H3