1-(2,3-dimethylphenyl)-3-[[(2S)-2-methylheptyl]carbamothioylamino]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[[(2S)-2-methylheptyl]carbamothioylamino]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[[(2S)-2-methylheptyl]carbamothioylamino]thiourea CAS Name: 1-[[(2,3-dimethylanilino)-sulfanylidenemethyl]amino]-3-[(2S)-2-methylheptyl]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[[(2S)-2-methylheptyl]carbamothioylamino]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[[(2S)-2-methylheptyl]thiocarbamoylamino]thiourea Formula: C18H30N4S2 MolecularWeight: 366.5876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=S)NC1=CC=CC(=C1C)C

Isomeric SMILES

CCCCC[C@H](C)CNC(=S)NNC(=S)NC1=CC=CC(=C1C)C

InChI

InChI=1S/C18H30N4S2/c1-5-6-7-9-13(2)12-19-17(23)21-22-18(24)20-16-11-8-10-14(3)15(16)4/h8,10-11,13H,5-7,9,12H2,1-4H3,(H2,19,21,23)(H2,20,22,24)/t13-/m0/s1