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

Systemtic Name: methyl 2-(2-phenylsulfanylethanoylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-[(2-phenylsulfanylacetyl)amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[1-oxo-2-(phenylthio)ethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-phenylsulfanylacetyl)amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[2-(phenylthio)acetyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C17H14N2O3S2 MolecularWeight: 358.43466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O3S2/c1-22-16(21)11-7-8-13-14(9-11)24-17(18-13)19-15(20)10-23-12-5-3-2-4-6-12/h2-9H,10H2,1H3,(H,18,19,20)