1-(2-methylphenyl)-3-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]thiourea

Systemtic Name: 1-(2-methylphenyl)-3-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]thiourea Openeye Name: 1-(o-tolyl)-3-[[(2R)-tetrahydrofuran-2-yl]methylcarbamothioylamino]thiourea CAS Name: 1-[[(2-methylanilino)-sulfanylidenemethyl]amino]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]thiourea Traditional Name: 1-(o-tolyl)-3-[[(2R)-tetrahydrofuran-2-yl]methylthiocarbamoylamino]thiourea Formula: C14H20N4OS2 MolecularWeight: 324.4648

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NNC(=S)NCC2CCCO2

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NNC(=S)NC[C@H]2CCCO2

InChI

InChI=1S/C14H20N4OS2/c1-10-5-2-3-7-12(10)16-14(21)18-17-13(20)15-9-11-6-4-8-19-11/h2-3,5,7,11H,4,6,8-9H2,1H3,(H2,15,17,20)(H2,16,18,21)/t11-/m1/s1