2,3-bis(azanyl)-2-[(3-methyl-1-benzothiophen-2-yl)sulfonyl]propanoic acid

Systemtic Name: 2,3-bis(azanyl)-2-[(3-methyl-1-benzothiophen-2-yl)sulfonyl]propanoic acid Openeye Name: 2,3-diamino-2-(3-methylbenzothiophen-2-yl)sulfonyl-propanoic acid CAS Name: 2,3-diamino-2-[(3-methyl-1-benzothiophen-2-yl)sulfonyl]propanoic acid IUPAC Name: 2,3-diamino-2-[(3-methyl-1-benzothiophen-2-yl)sulfonyl]propanoic acid Traditional Name: 2,3-diamino-2-(3-methylbenzothiophen-2-yl)sulfonyl-propionic acid Formula: C12H14N2O4S2 MolecularWeight: 314.38056

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)S(=O)(=O)C(CN)(C(=O)O)N

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)S(=O)(=O)C(CN)(C(=O)O)N

InChI

InChI=1S/C12H14N2O4S2/c1-7-8-4-2-3-5-9(8)19-10(7)20(17,18)12(14,6-13)11(15)16/h2-5H,6,13-14H2,1H3,(H,15,16)