1-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-3-(3,4-dimethoxyphenyl)thiourea

Systemtic Name: 1-[2-(2-chloranyl-6-fluoranyl-phenyl)ethanoylamino]-3-(3,4-dimethoxyphenyl)thiourea Openeye Name: 1-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-3-(3,4-dimethoxyphenyl)thiourea CAS Name: 1-[[2-(2-chloro-6-fluorophenyl)-1-oxoethyl]amino]-3-(3,4-dimethoxyphenyl)thiourea IUPAC Name: 1-[[2-(2-chloro-6-fluorophenyl)acetyl]amino]-3-(3,4-dimethoxyphenyl)thiourea Traditional Name: 1-[[2-(2-chloro-6-fluoro-phenyl)acetyl]amino]-3-(3,4-dimethoxyphenyl)thiourea Formula: C17H17ClFN3O3S MolecularWeight: 397.851583

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NNC(=O)CC2=C(C=CC=C2Cl)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NNC(=O)CC2=C(C=CC=C2Cl)F)OC

InChI

InChI=1S/C17H17ClFN3O3S/c1-24-14-7-6-10(8-15(14)25-2)20-17(26)22-21-16(23)9-11-12(18)4-3-5-13(11)19/h3-8H,9H2,1-2H3,(H,21,23)(H2,20,22,26)