1-(3-chloranyl-4-methyl-phenyl)-3-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]thiourea

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-3-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]thiourea Openeye Name: 1-(3-chloro-4-methyl-phenyl)-3-[[(2R)-tetrahydrofuran-2-yl]methylcarbamothioylamino]thiourea CAS Name: 1-[[(3-chloro-4-methylanilino)-sulfanylidenemethyl]amino]-3-[[(2R)-2-oxolanyl]methyl]thiourea IUPAC Name: 1-(3-chloro-4-methylphenyl)-3-[[(2R)-oxolan-2-yl]methylcarbamothioylamino]thiourea Traditional Name: 1-(3-chloro-4-methyl-phenyl)-3-[[(2R)-tetrahydrofuran-2-yl]methylthiocarbamoylamino]thiourea Formula: C14H19ClN4OS2 MolecularWeight: 358.90986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19ClN4OS2/c1-9-4-5-10(7-12(9)15)17-14(22)19-18-13(21)16-8-11-3-2-6-20-11/h4-5,7,11H,2-3,6,8H2,1H3,(H2,16,18,21)(H2,17,19,22)/t11-/m1/s1