1-(2-chloranyl-4,6-dimethyl-phenyl)-3-(prop-2-enylcarbamothioylamino)thiourea

Systemtic Name: 1-(2-chloranyl-4,6-dimethyl-phenyl)-3-(prop-2-enylcarbamothioylamino)thiourea Openeye Name: 1-allyl-3-[(2-chloro-4,6-dimethyl-phenyl)carbamothioylamino]thiourea CAS Name: 1-[[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]amino]-3-prop-2-enylthiourea IUPAC Name: 1-(2-chloro-4,6-dimethylphenyl)-3-(prop-2-enylcarbamothioylamino)thiourea Traditional Name: 1-allyl-3-[(2-chloro-4,6-dimethyl-phenyl)thiocarbamoylamino]thiourea Formula: C13H17ClN4S2 MolecularWeight: 328.88388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=S)NNC(=S)NCC=C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=S)NNC(=S)NCC=C)C

InChI

InChI=1S/C13H17ClN4S2/c1-4-5-15-12(19)17-18-13(20)16-11-9(3)6-8(2)7-10(11)14/h4,6-7H,1,5H2,2-3H3,(H2,15,17,19)(H2,16,18,20)