methyl 2-[[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]phenyl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[4-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]phenyl]carbonylamino]ethanoate Openeye Name: methyl 2-[[4-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]benzoyl]amino]acetate CAS Name: 2-[[[4-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[4-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]benzoyl]amino]acetate Traditional Name: 2-[[4-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]benzoyl]amino]acetic acid methyl ester Formula: C19H17N3O4S2 MolecularWeight: 415.48598

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)CNC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H17N3O4S2/c1-26-17(24)10-20-18(25)12-6-8-13(9-7-12)21-16(23)11-27-19-22-14-4-2-3-5-15(14)28-19/h2-9H,10-11H2,1H3,(H,20,25)(H,21,23)