ethyl 4-[[2-[(3-fluorophenyl)methylsulfanyl]ethanoylamino]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[2-[(3-fluorophenyl)methylsulfanyl]ethanoylamino]carbamoylamino]benzoate Openeye Name: ethyl 4-[[[2-[(3-fluorophenyl)methylsulfanyl]acetyl]amino]carbamoylamino]benzoate CAS Name: 4-[[[[2-[(3-fluorophenyl)methylthio]-1-oxoethyl]hydrazo]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[[2-[(3-fluorophenyl)methylsulfanyl]acetyl]amino]carbamoylamino]benzoate Traditional Name: 4-[[[2-[(3-fluorobenzyl)thio]acetyl]amino]carbamoylamino]benzoic acid ethyl ester Formula: C19H20FN3O4S MolecularWeight: 405.443203

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NNC(=O)CSCC2=CC(=CC=C2)F

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NNC(=O)CSCC2=CC(=CC=C2)F

InChI

InChI=1S/C19H20FN3O4S/c1-2-27-18(25)14-6-8-16(9-7-14)21-19(26)23-22-17(24)12-28-11-13-4-3-5-15(20)10-13/h3-10H,2,11-12H2,1H3,(H,22,24)(H2,21,23,26)