1-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-4-[(4-methoxyphenyl)methyl]piperazine

Systemtic Name: 1-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-4-[(4-methoxyphenyl)methyl]piperazine Openeye Name: 1-[(4-methoxyphenyl)methyl]-4-[4-[(1S)-1-methylpropyl]phenyl]sulfonyl-piperazine CAS Name: 1-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-4-[(4-methoxyphenyl)methyl]piperazine IUPAC Name: 1-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-4-[(4-methoxyphenyl)methyl]piperazine Traditional Name: 1-[4-[(1S)-1-methylpropyl]phenyl]sulfonyl-4-p-anisyl-piperazine Formula: C22H30N2O3S MolecularWeight: 402.5502

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H30N2O3S/c1-4-18(2)20-7-11-22(12-8-20)28(25,26)24-15-13-23(14-16-24)17-19-5-9-21(27-3)10-6-19/h5-12,18H,4,13-17H2,1-3H3/t18-/m0/s1