1-(3-chloranyl-4-fluoranyl-phenyl)-3-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]thiourea

Systemtic Name: 1-(3-chloranyl-4-fluoranyl-phenyl)-3-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]thiourea Openeye Name: 1-(3-chloro-4-fluoro-phenyl)-3-[3-(4-methoxyphenyl)isoxazol-5-yl]thiourea CAS Name: 1-(3-chloro-4-fluorophenyl)-3-[3-(4-methoxyphenyl)-5-isoxazolyl]thiourea IUPAC Name: 1-(3-chloro-4-fluorophenyl)-3-[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]thiourea Traditional Name: 1-(3-chloro-4-fluoro-phenyl)-3-[3-(4-methoxyphenyl)isoxazol-5-yl]thiourea Formula: C17H13ClFN3O2S MolecularWeight: 377.820423

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=C2)NC(=S)NC3=CC(=C(C=C3)F)Cl

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=C2)NC(=S)NC3=CC(=C(C=C3)F)Cl

InChI

InChI=1S/C17H13ClFN3O2S/c1-23-12-5-2-10(3-6-12)15-9-16(24-22-15)21-17(25)20-11-4-7-14(19)13(18)8-11/h2-9H,1H3,(H2,20,21,25)