1-(4-butylphenyl)-3-[4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]thiourea

Systemtic Name: 1-(4-butylphenyl)-3-[4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]thiourea Openeye Name: 1-(4-butylphenyl)-3-[4-[[(3S,5S)-3,5-dimethyl-1-piperidyl]sulfonyl]phenyl]thiourea CAS Name: 1-(4-butylphenyl)-3-[4-[[(3S,5S)-3,5-dimethyl-1-piperidinyl]sulfonyl]phenyl]thiourea IUPAC Name: 1-(4-butylphenyl)-3-[4-[(3S,5S)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]thiourea Traditional Name: 1-(4-butylphenyl)-3-[4-[(3S,5S)-3,5-dimethylpiperidino]sulfonylphenyl]thiourea Formula: C24H33N3O2S2 MolecularWeight: 459.66772

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CC(CC(C3)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3C[C@H](C[C@@H](C3)C)C

InChI

InChI=1S/C24H33N3O2S2/c1-4-5-6-20-7-9-21(10-8-20)25-24(30)26-22-11-13-23(14-12-22)31(28,29)27-16-18(2)15-19(3)17-27/h7-14,18-19H,4-6,15-17H2,1-3H3,(H2,25,26,30)/t18-,19-/m0/s1