1-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]ethanoylamino]-3-(3-methoxyphenyl)thiourea

Systemtic Name: 1-[2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]ethanoylamino]-3-(3-methoxyphenyl)thiourea Openeye Name: 1-[[2-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]acetyl]amino]-3-(3-methoxyphenyl)thiourea CAS Name: 1-[[2-[(2-chloro-4-fluorophenyl)methylthio]-1-oxoethyl]amino]-3-(3-methoxyphenyl)thiourea IUPAC Name: 1-[[2-[(2-chloro-4-fluorophenyl)methylsulfanyl]acetyl]amino]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[[2-[(2-chloro-4-fluoro-benzyl)thio]acetyl]amino]-3-(3-methoxyphenyl)thiourea Formula: C17H17ClFN3O2S2 MolecularWeight: 413.917183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17ClFN3O2S2/c1-24-14-4-2-3-13(8-14)20-17(25)22-21-16(23)10-26-9-11-5-6-12(19)7-15(11)18/h2-8H,9-10H2,1H3,(H,21,23)(H2,20,22,25)