methyl 3-oxidanyl-2-[(7-oxidanyl-2-thiophen-2-yl-1H-benzimidazol-4-yl)carbonylamino]propanoate

Systemtic Name: methyl 3-oxidanyl-2-[(7-oxidanyl-2-thiophen-2-yl-1H-benzimidazol-4-yl)carbonylamino]propanoate Openeye Name: methyl 3-hydroxy-2-[[7-hydroxy-2-(2-thienyl)-1H-benzimidazole-4-carbonyl]amino]propanoate CAS Name: 3-hydroxy-2-[[(7-hydroxy-2-thiophen-2-yl-1H-benzimidazol-4-yl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(7-hydroxy-2-thiophen-2-yl-1H-benzimidazole-4-carbonyl)amino]propanoate Traditional Name: 3-hydroxy-2-[[7-hydroxy-2-(2-thienyl)-1H-benzimidazole-4-carbonyl]amino]propionic acid methyl ester Formula: C16H15N3O5S MolecularWeight: 361.3724

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=C2C(=C(C=C1)O)NC(=N2)C3=CC=CS3

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=C2C(=C(C=C1)O)NC(=N2)C3=CC=CS3

InChI

InChI=1S/C16H15N3O5S/c1-24-16(23)9(7-20)17-15(22)8-4-5-10(21)13-12(8)18-14(19-13)11-3-2-6-25-11/h2-6,9,20-21H,7H2,1H3,(H,17,22)(H,18,19)