1-[[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]carbonylamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylphenyl]carbonylamino]-3-propan-2-yl-thiourea Openeye Name: 1-[[4-[[(3R,5R)-3,5-dimethyl-1-piperidyl]sulfonyl]benzoyl]amino]-3-isopropyl-thiourea CAS Name: 1-[[[4-[[(3R,5R)-3,5-dimethyl-1-piperidinyl]sulfonyl]phenyl]-oxomethyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[[4-[(3R,5R)-3,5-dimethylpiperidin-1-yl]sulfonylbenzoyl]amino]-3-propan-2-ylthiourea Traditional Name: 1-[[4-[(3R,5R)-3,5-dimethylpiperidino]sulfonylbenzoyl]amino]-3-isopropyl-thiourea Formula: C18H28N4O3S2 MolecularWeight: 412.56992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H28N4O3S2/c1-12(2)19-18(26)21-20-17(23)15-5-7-16(8-6-15)27(24,25)22-10-13(3)9-14(4)11-22/h5-8,12-14H,9-11H2,1-4H3,(H,20,23)(H2,19,21,26)/t13-,14-/m1/s1