1-(3,4-dimethylphenyl)-3-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]thiourea CAS Name: 1-[[(3,4-dimethylanilino)-sulfanylidenemethyl]amino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[[(1S,2S)-2-methylcyclohexyl]carbamothioylamino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[[(1S,2S)-2-methylcyclohexyl]thiocarbamoylamino]thiourea Formula: C17H26N4S2 MolecularWeight: 350.54514

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC(=S)NC2=CC(=C(C=C2)C)C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NNC(=S)NC2=CC(=C(C=C2)C)C

InChI

InChI=1S/C17H26N4S2/c1-11-8-9-14(10-13(11)3)18-16(22)20-21-17(23)19-15-7-5-4-6-12(15)2/h8-10,12,15H,4-7H2,1-3H3,(H2,18,20,22)(H2,19,21,23)/t12-,15-/m0/s1