1-(3,5-dimethylphenyl)-3-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]thiourea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]thiourea Openeye Name: 1-(3,5-dimethylphenyl)-3-[[(2R)-tetrahydrofuran-2-yl]methylcarbamothioylamino]thiourea CAS Name: 1-[[(3,5-dimethylanilino)-sulfanylidenemethyl]amino]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]thiourea Traditional Name: 1-(3,5-dimethylphenyl)-3-[[(2R)-tetrahydrofuran-2-yl]methylthiocarbamoylamino]thiourea Formula: C15H22N4OS2 MolecularWeight: 338.49138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NNC(=S)NCC2CCCO2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NNC(=S)NC[C@H]2CCCO2)C

InChI

InChI=1S/C15H22N4OS2/c1-10-6-11(2)8-12(7-10)17-15(22)19-18-14(21)16-9-13-4-3-5-20-13/h6-8,13H,3-5,9H2,1-2H3,(H2,16,18,21)(H2,17,19,22)/t13-/m1/s1