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

Systemtic Name: ethyl 4-[[2-[(3-methylphenyl)methylsulfanyl]ethanoylamino]carbamoylamino]benzoate Openeye Name: ethyl 4-[[[2-(m-tolylmethylsulfanyl)acetyl]amino]carbamoylamino]benzoate CAS Name: 4-[[[[2-[(3-methylphenyl)methylthio]-1-oxoethyl]hydrazo]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[[2-[(3-methylphenyl)methylsulfanyl]acetyl]amino]carbamoylamino]benzoate Traditional Name: 4-[[[2-[(3-methylbenzyl)thio]acetyl]amino]carbamoylamino]benzoic acid ethyl ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O4S/c1-3-27-19(25)16-7-9-17(10-8-16)21-20(26)23-22-18(24)13-28-12-15-6-4-5-14(2)11-15/h4-11H,3,12-13H2,1-2H3,(H,22,24)(H2,21,23,26)