1-(2-chloranyl-4,6-dimethyl-phenyl)-3-[(3-methoxyphenyl)carbamothioylamino]thiourea

Systemtic Name: 1-(2-chloranyl-4,6-dimethyl-phenyl)-3-[(3-methoxyphenyl)carbamothioylamino]thiourea Openeye Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-[(3-methoxyphenyl)carbamothioylamino]thiourea CAS Name: 1-[[(2-chloro-4,6-dimethylanilino)-sulfanylidenemethyl]amino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-(2-chloro-4,6-dimethylphenyl)-3-[(3-methoxyphenyl)carbamothioylamino]thiourea Traditional Name: 1-(2-chloro-4,6-dimethyl-phenyl)-3-[(3-methoxyphenyl)thiocarbamoylamino]thiourea Formula: C17H19ClN4OS2 MolecularWeight: 394.94196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=S)NNC(=S)NC2=CC(=CC=C2)OC)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=S)NNC(=S)NC2=CC(=CC=C2)OC)C

InChI

InChI=1S/C17H19ClN4OS2/c1-10-7-11(2)15(14(18)8-10)20-17(25)22-21-16(24)19-12-5-4-6-13(9-12)23-3/h4-9H,1-3H3,(H2,19,21,24)(H2,20,22,25)