1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea

Systemtic Name: 1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Openeye Name: 1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea CAS Name: 1-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-[3-(4-fluorophenyl)sulfanylpropanoylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Traditional Name: 1-[3-[(4-fluorophenyl)thio]propanoylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C17H24FN3OS2 MolecularWeight: 369.520363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC(=O)CCSC2=CC=C(C=C2)F

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NNC(=O)CCSC2=CC=C(C=C2)F

InChI

InChI=1S/C17H24FN3OS2/c1-12-4-2-3-5-15(12)19-17(23)21-20-16(22)10-11-24-14-8-6-13(18)7-9-14/h6-9,12,15H,2-5,10-11H2,1H3,(H,20,22)(H2,19,21,23)/t12-,15-/m0/s1