methyl 2-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfonylbenzimidazol-1-yl]ethanoate

Systemtic Name: methyl 2-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfonylbenzimidazol-1-yl]ethanoate Openeye Name: methyl 2-[2-(2-amino-2-oxo-ethyl)sulfonylbenzimidazol-1-yl]acetate CAS Name: 2-[2-(2-amino-2-oxoethyl)sulfonyl-1-benzimidazolyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2-amino-2-oxoethyl)sulfonylbenzimidazol-1-yl]acetate Traditional Name: 2-[2-(2-amino-2-keto-ethyl)sulfonylbenzimidazol-1-yl]acetic acid methyl ester Formula: C12H13N3O5S MolecularWeight: 311.31372

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C2=CC=CC=C2N=C1S(=O)(=O)CC(=O)N

Isomeric SMILES

COC(=O)CN1C2=CC=CC=C2N=C1S(=O)(=O)CC(=O)N

InChI

InChI=1S/C12H13N3O5S/c1-20-11(17)6-15-9-5-3-2-4-8(9)14-12(15)21(18,19)7-10(13)16/h2-5H,6-7H2,1H3,(H2,13,16)