[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-(1H-indol-3-yl)methanone

Systemtic Name: [4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-(1H-indol-3-yl)methanone Openeye Name: 1H-indol-3-yl-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: [4-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-1-piperazinyl]-(1H-indol-3-yl)methanone IUPAC Name: [4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-(1H-indol-3-yl)methanone Traditional Name: 1H-indol-3-yl-[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazino]methanone Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3S/c1-3-17(2)18-8-10-19(11-9-18)30(28,29)26-14-12-25(13-15-26)23(27)21-16-24-22-7-5-4-6-20(21)22/h4-11,16-17,24H,3,12-15H2,1-2H3/t17-/m0/s1