1-(2,5-dimethylphenyl)-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]thiourea

Systemtic Name: 1-(2,5-dimethylphenyl)-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]thiourea Openeye Name: 1-(2,5-dimethylphenyl)-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]thiourea CAS Name: 1-(2,5-dimethylphenyl)-3-[[3-[(4-fluorophenyl)thio]-1-oxopropyl]amino]thiourea IUPAC Name: 1-(2,5-dimethylphenyl)-3-[3-(4-fluorophenyl)sulfanylpropanoylamino]thiourea Traditional Name: 1-(2,5-dimethylphenyl)-3-[3-[(4-fluorophenyl)thio]propanoylamino]thiourea Formula: C18H20FN3OS2 MolecularWeight: 377.499303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NNC(=O)CCSC2=CC=C(C=C2)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NNC(=O)CCSC2=CC=C(C=C2)F

InChI

InChI=1S/C18H20FN3OS2/c1-12-3-4-13(2)16(11-12)20-18(24)22-21-17(23)9-10-25-15-7-5-14(19)6-8-15/h3-8,11H,9-10H2,1-2H3,(H,21,23)(H2,20,22,24)