1-[3-[4-(1-methylindol-3-yl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[3-[4-(1-methylindol-3-yl)carbonylpiperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[3-[4-(1-methylindole-3-carbonyl)piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[3-[[4-[(1-methyl-3-indolyl)-oxomethyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[3-[4-(1-methylindole-3-carbonyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[3-[4-(1-methylindole-3-carbonyl)piperazino]sulfonylphenyl]ethanone Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(C4=CC=CC=C43)C

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C22H23N3O4S/c1-16(26)17-6-5-7-18(14-17)30(28,29)25-12-10-24(11-13-25)22(27)20-15-23(2)21-9-4-3-8-19(20)21/h3-9,14-15H,10-13H2,1-2H3