1-(3-methylbutyl)-3-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]thiourea Openeye Name: 1-isopentyl-3-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[[[(1S,2S)-2-methylcyclohexyl]amino]-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]thiourea Traditional Name: 1-isoamyl-3-[[(1S,2S)-2-methylcyclohexyl]thiocarbamoylamino]thiourea Formula: C14H28N4S2 MolecularWeight: 316.52892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC(=S)NCCC(C)C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NNC(=S)NCCC(C)C

InChI

InChI=1S/C14H28N4S2/c1-10(2)8-9-15-13(19)17-18-14(20)16-12-7-5-4-6-11(12)3/h10-12H,4-9H2,1-3H3,(H2,15,17,19)(H2,16,18,20)/t11-,12-/m0/s1