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

Systemtic Name: 1-[4-[(3S,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-3-methyl-thiourea Openeye Name: 1-[4-[[(3S,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]phenyl]-3-methyl-thiourea CAS Name: 1-[4-[[(3S,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]phenyl]-3-methylthiourea IUPAC Name: 1-[4-[(3S,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]-3-methylthiourea Traditional Name: 1-[4-[(3S,5R)-3,5-dimethylpiperidino]sulfonylphenyl]-3-methyl-thiourea Formula: C15H23N3O2S2 MolecularWeight: 341.49202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC)C

Isomeric SMILES

C[C@@H]1C[C@@H](CN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC)C

InChI

InChI=1S/C15H23N3O2S2/c1-11-8-12(2)10-18(9-11)22(19,20)14-6-4-13(5-7-14)17-15(21)16-3/h4-7,11-12H,8-10H2,1-3H3,(H2,16,17,21)/t11-,12+