1-(3,4-dimethylphenyl)-3-[(4-fluorophenyl)methylcarbamothioylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[(4-fluorophenyl)methylcarbamothioylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[(4-fluorophenyl)methylcarbamothioylamino]thiourea CAS Name: 1-[[(3,4-dimethylanilino)-sulfanylidenemethyl]amino]-3-[(4-fluorophenyl)methyl]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[(4-fluorophenyl)methylcarbamothioylamino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[(4-fluorobenzyl)thiocarbamoylamino]thiourea Formula: C17H19FN4S2 MolecularWeight: 362.487963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=S)NCC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=S)NCC2=CC=C(C=C2)F)C

InChI

InChI=1S/C17H19FN4S2/c1-11-3-8-15(9-12(11)2)20-17(24)22-21-16(23)19-10-13-4-6-14(18)7-5-13/h3-9H,10H2,1-2H3,(H2,19,21,23)(H2,20,22,24)