1-(2-tert-butylcyclohexyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea

Systemtic Name: 1-(2-tert-butylcyclohexyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Openeye Name: 1-(2-tert-butylcyclohexyl)-3-[4-[(2,6-dimethyl-1-piperidyl)sulfonyl]phenyl]thiourea CAS Name: 1-(2-tert-butylcyclohexyl)-3-[4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]phenyl]thiourea IUPAC Name: 1-(2-tert-butylcyclohexyl)-3-[4-(2,6-dimethylpiperidin-1-yl)sulfonylphenyl]thiourea Traditional Name: 1-(2-tert-butylcyclohexyl)-3-[4-(2,6-dimethylpiperidino)sulfonylphenyl]thiourea Formula: C24H39N3O2S2 MolecularWeight: 465.71536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3CCCCC3C(C)(C)C)C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3CCCCC3C(C)(C)C)C

InChI

InChI=1S/C24H39N3O2S2/c1-17-9-8-10-18(2)27(17)31(28,29)20-15-13-19(14-16-20)25-23(30)26-22-12-7-6-11-21(22)24(3,4)5/h13-18,21-22H,6-12H2,1-5H3,(H2,25,26,30)