1-(3,4-dimethylphenyl)-3-[2-[(4-fluorophenyl)methylsulfanyl]ethanoylamino]thiourea

Systemtic Name: 1-(3,4-dimethylphenyl)-3-[2-[(4-fluorophenyl)methylsulfanyl]ethanoylamino]thiourea Openeye Name: 1-(3,4-dimethylphenyl)-3-[[2-[(4-fluorophenyl)methylsulfanyl]acetyl]amino]thiourea CAS Name: 1-(3,4-dimethylphenyl)-3-[[2-[(4-fluorophenyl)methylthio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3,4-dimethylphenyl)-3-[[2-[(4-fluorophenyl)methylsulfanyl]acetyl]amino]thiourea Traditional Name: 1-(3,4-dimethylphenyl)-3-[[2-[(4-fluorobenzyl)thio]acetyl]amino]thiourea Formula: C18H20FN3OS2 MolecularWeight: 377.499303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)NNC(=O)CSCC2=CC=C(C=C2)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)NNC(=O)CSCC2=CC=C(C=C2)F)C

InChI

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