1-butyl-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-butyl-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea Openeye Name: 1-butyl-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea CAS Name: 1-butyl-3-[[(3,5-dimethylanilino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-butyl-3-[(3,5-dimethylphenyl)carbamothioylamino]thiourea Traditional Name: 1-butyl-3-[(3,5-dimethylphenyl)thiocarbamoylamino]thiourea Formula: C14H22N4S2 MolecularWeight: 310.48128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=S)NC1=CC(=CC(=C1)C)C

Isomeric SMILES

CCCCNC(=S)NNC(=S)NC1=CC(=CC(=C1)C)C

InChI

InChI=1S/C14H22N4S2/c1-4-5-6-15-13(19)17-18-14(20)16-12-8-10(2)7-11(3)9-12/h7-9H,4-6H2,1-3H3,(H2,15,17,19)(H2,16,18,20)