4-[2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanoyl]piperazine-1-carbaldehyde

Systemtic Name: 4-[2-[3-(4-methylphenyl)sulfonylindol-1-yl]ethanoyl]piperazine-1-carbaldehyde Openeye Name: 4-[2-[3-(p-tolylsulfonyl)indol-1-yl]acetyl]piperazine-1-carbaldehyde CAS Name: 4-[2-[3-(4-methylphenyl)sulfonyl-1-indolyl]-1-oxoethyl]-1-piperazinecarboxaldehyde IUPAC Name: 4-[2-[3-(4-methylphenyl)sulfonylindol-1-yl]acetyl]piperazine-1-carbaldehyde Traditional Name: 4-[2-(3-tosylindol-1-yl)acetyl]piperazine-1-carbaldehyde Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCN(CC4)C=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C2=CN(C3=CC=CC=C32)CC(=O)N4CCN(CC4)C=O

InChI

InChI=1S/C22H23N3O4S/c1-17-6-8-18(9-7-17)30(28,29)21-14-25(20-5-3-2-4-19(20)21)15-22(27)24-12-10-23(16-26)11-13-24/h2-9,14,16H,10-13,15H2,1H3