2-[3-(trifluoromethyl)phenyl]sulfanylethyl 4-(aminocarbonylamino)benzoate

Systemtic Name: 2-[3-(trifluoromethyl)phenyl]sulfanylethyl 4-(aminocarbonylamino)benzoate Openeye Name: 2-[3-(trifluoromethyl)phenyl]sulfanylethyl 4-ureidobenzoate CAS Name: 4-(carbamoylamino)benzoic acid 2-[[3-(trifluoromethyl)phenyl]thio]ethyl ester IUPAC Name: 2-[3-(trifluoromethyl)phenyl]sulfanylethyl 4-(carbamoylamino)benzoate Traditional Name: 4-ureidobenzoic acid 2-[[3-(trifluoromethyl)phenyl]thio]ethyl ester Formula: C17H15F3N2O3S MolecularWeight: 384.37281

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SCCOC(=O)C2=CC=C(C=C2)NC(=O)N)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)SCCOC(=O)C2=CC=C(C=C2)NC(=O)N)C(F)(F)F

InChI

InChI=1S/C17H15F3N2O3S/c18-17(19,20)12-2-1-3-14(10-12)26-9-8-25-15(23)11-4-6-13(7-5-11)22-16(21)24/h1-7,10H,8-9H2,(H3,21,22,24)