ethyl 4-[2-[(4-ethoxycarbonylphenyl)carbamoylsulfanyl]ethylsulfanylcarbonylamino]benzoate

Systemtic Name: ethyl 4-[2-[(4-ethoxycarbonylphenyl)carbamoylsulfanyl]ethylsulfanylcarbonylamino]benzoate Openeye Name: ethyl 4-[2-[(4-ethoxycarbonylphenyl)carbamoylsulfanyl]ethylsulfanylcarbonylamino]benzoate CAS Name: 4-[[[2-[[(4-ethoxycarbonylanilino)-oxomethyl]thio]ethylthio]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-ethoxycarbonylphenyl)carbamoylsulfanyl]ethylsulfanylcarbonylamino]benzoate Traditional Name: 4-[[2-[(4-carbethoxyphenyl)carbamoylthio]ethylthio]carbonylamino]benzoic acid ethyl ester Formula: C22H24N2O6S2 MolecularWeight: 476.56576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)SCCSC(=O)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)SCCSC(=O)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C22H24N2O6S2/c1-3-29-19(25)15-5-9-17(10-6-15)23-21(27)31-13-14-32-22(28)24-18-11-7-16(8-12-18)20(26)30-4-2/h5-12H,3-4,13-14H2,1-2H3,(H,23,27)(H,24,28)