(3S)-3-phenyl-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: (3S)-3-phenyl-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: (3S)-1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-3-phenyl-butan-1-one CAS Name: (3S)-3-phenyl-1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: (3S)-3-phenyl-1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]butan-1-one Traditional Name: (3S)-1-(4-p-cumenylsulfonylpiperazino)-3-phenyl-butan-1-one Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC(C)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(C)C)C3=CC=CC=C3

InChI

InChI=1S/C23H30N2O3S/c1-18(2)20-9-11-22(12-10-20)29(27,28)25-15-13-24(14-16-25)23(26)17-19(3)21-7-5-4-6-8-21/h4-12,18-19H,13-17H2,1-3H3/t19-/m0/s1