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

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-[2-[(4-fluorophenyl)methylsulfanyl]ethanoylamino]thiourea Openeye Name: 1-(3,4-dimethoxyphenyl)-3-[[2-[(4-fluorophenyl)methylsulfanyl]acetyl]amino]thiourea CAS Name: 1-(3,4-dimethoxyphenyl)-3-[[2-[(4-fluorophenyl)methylthio]-1-oxoethyl]amino]thiourea IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-[[2-[(4-fluorophenyl)methylsulfanyl]acetyl]amino]thiourea Traditional Name: 1-(3,4-dimethoxyphenyl)-3-[[2-[(4-fluorobenzyl)thio]acetyl]amino]thiourea Formula: C18H20FN3O3S2 MolecularWeight: 409.498103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NNC(=O)CSCC2=CC=C(C=C2)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NNC(=O)CSCC2=CC=C(C=C2)F)OC

InChI

InChI=1S/C18H20FN3O3S2/c1-24-15-8-7-14(9-16(15)25-2)20-18(26)22-21-17(23)11-27-10-12-3-5-13(19)6-4-12/h3-9H,10-11H2,1-2H3,(H,21,23)(H2,20,22,26)