1-butyl-3-[(4-methylphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-butyl-3-[(4-methylphenyl)carbamothioylamino]thiourea Openeye Name: 1-butyl-3-(p-tolylcarbamothioylamino)thiourea CAS Name: 1-butyl-3-[[(4-methylanilino)-sulfanylidenemethyl]amino]thiourea IUPAC Name: 1-butyl-3-[(4-methylphenyl)carbamothioylamino]thiourea Traditional Name: 1-butyl-3-(p-tolylthiocarbamoylamino)thiourea Formula: C13H20N4S2 MolecularWeight: 296.4547

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N4S2/c1-3-4-9-14-12(18)16-17-13(19)15-11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H2,14,16,18)(H2,15,17,19)