1-[[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]methyl]-3-methyl-imidazole-2-thione

Systemtic Name: 1-[[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]methyl]-3-methyl-imidazole-2-thione Openeye Name: 1-methyl-3-[[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]methyl]imidazole-2-thione CAS Name: 1-[[4-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-1-piperazinyl]methyl]-3-methyl-2-imidazolethione IUPAC Name: 1-[[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]methyl]-3-methylimidazole-2-thione Traditional Name: 1-methyl-3-[[4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazino]methyl]-4-imidazoline-2-thione Formula: C19H28N4O2S2 MolecularWeight: 408.58122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C=CN(C3=S)C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C=CN(C3=S)C

InChI

InChI=1S/C19H28N4O2S2/c1-4-16(2)17-5-7-18(8-6-17)27(24,25)23-13-10-21(11-14-23)15-22-12-9-20(3)19(22)26/h5-9,12,16H,4,10-11,13-15H2,1-3H3/t16-/m0/s1