(3S)-3-phenyl-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]butan-1-one

Systemtic Name: (3S)-3-phenyl-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]butan-1-one Openeye Name: (3S)-3-phenyl-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]butan-1-one CAS Name: (3S)-3-phenyl-1-[4-(4-propylphenyl)sulfonyl-1-piperazinyl]-1-butanone IUPAC Name: (3S)-3-phenyl-1-[4-(4-propylphenyl)sulfonylpiperazin-1-yl]butan-1-one Traditional Name: (3S)-3-phenyl-1-[4-(4-propylphenyl)sulfonylpiperazino]butan-1-one Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CC(C)C3=CC=CC=C3

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C[C@H](C)C3=CC=CC=C3

InChI

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