1-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]ethanoylamino]-3-(2-methoxy-5-methyl-phenyl)thiourea

Systemtic Name: 1-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]ethanoylamino]-3-(2-methoxy-5-methyl-phenyl)thiourea Openeye Name: 1-[[2-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]acetyl]amino]-3-(2-methoxy-5-methyl-phenyl)thiourea CAS Name: 1-[[2-[(2-chloro-4-fluorophenyl)methylthio]-1-oxoethyl]amino]-3-(2-methoxy-5-methylphenyl)thiourea IUPAC Name: 1-[[2-[(2-chloro-4-fluorophenyl)methylsulfanyl]acetyl]amino]-3-(2-methoxy-5-methylphenyl)thiourea Traditional Name: 1-[[2-[(2-chloro-4-fluoro-benzyl)thio]acetyl]amino]-3-(2-methoxy-5-methyl-phenyl)thiourea Formula: C18H19ClFN3O2S2 MolecularWeight: 427.943763

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClFN3O2S2/c1-11-3-6-16(25-2)15(7-11)21-18(26)23-22-17(24)10-27-9-12-4-5-13(20)8-14(12)19/h3-8H,9-10H2,1-2H3,(H,22,24)(H2,21,23,26)