methyl 2-[[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]carbamoylamino]benzoate

Systemtic Name: methyl 2-[[(2-phenyl-2-phenylsulfanyl-ethanoyl)amino]carbamoylamino]benzoate Openeye Name: methyl 2-[[(2-phenyl-2-phenylsulfanyl-acetyl)amino]carbamoylamino]benzoate CAS Name: 2-[[oxo-[[1-oxo-2-phenyl-2-(phenylthio)ethyl]hydrazo]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(2-phenyl-2-phenylsulfanylacetyl)amino]carbamoylamino]benzoate Traditional Name: 2-[[[2-phenyl-2-(phenylthio)acetyl]amino]carbamoylamino]benzoic acid methyl ester Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)NNC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)NNC(=O)C(C2=CC=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O4S/c1-30-22(28)18-14-8-9-15-19(18)24-23(29)26-25-21(27)20(16-10-4-2-5-11-16)31-17-12-6-3-7-13-17/h2-15,20H,1H3,(H,25,27)(H2,24,26,29)