ethyl 2-(2-phenylsulfanylethanoylamino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-(2-phenylsulfanylethanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[(2-phenylsulfanylacetyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[1-oxo-2-(phenylthio)ethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-phenylsulfanylacetyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-(phenylthio)acetyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C18H16N2O3S2 MolecularWeight: 372.46124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=CC=C3

InChI

InChI=1S/C18H16N2O3S2/c1-2-23-17(22)12-8-9-14-15(10-12)25-18(19-14)20-16(21)11-24-13-6-4-3-5-7-13/h3-10H,2,11H2,1H3,(H,19,20,21)