1-[3-(4-chloranyl-2-fluoranyl-phenyl)prop-2-enoylamino]-3-(2,5-dimethoxyphenyl)thiourea

Systemtic Name: 1-[3-(4-chloranyl-2-fluoranyl-phenyl)prop-2-enoylamino]-3-(2,5-dimethoxyphenyl)thiourea Openeye Name: 1-[3-(4-chloro-2-fluoro-phenyl)prop-2-enoylamino]-3-(2,5-dimethoxyphenyl)thiourea CAS Name: 1-[[3-(4-chloro-2-fluorophenyl)-1-oxoprop-2-enyl]amino]-3-(2,5-dimethoxyphenyl)thiourea IUPAC Name: 1-[3-(4-chloro-2-fluorophenyl)prop-2-enoylamino]-3-(2,5-dimethoxyphenyl)thiourea Traditional Name: 1-[[3-(4-chloro-2-fluoro-phenyl)acryloyl]amino]-3-(2,5-dimethoxyphenyl)thiourea Formula: C18H17ClFN3O3S MolecularWeight: 409.862283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)NC(=S)NNC(=O)C=CC2=C(C=C(C=C2)Cl)F

Isomeric SMILES

COC1=CC(=C(C=C1)OC)NC(=S)NNC(=O)C=CC2=C(C=C(C=C2)Cl)F

InChI

InChI=1S/C18H17ClFN3O3S/c1-25-13-6-7-16(26-2)15(10-13)21-18(27)23-22-17(24)8-4-11-3-5-12(19)9-14(11)20/h3-10H,1-2H3,(H,22,24)(H2,21,23,27)