Vitas-M small molecule compound
4-{[(6-methyl-2-oxo-2,3-dihydro-1H-benzimidazol-5-yl)sulfonyl]amino}butanoic acid
Catalog ID
STK982323
SMILES OC(=O)CCCNS(=O)(=O)c1cc2[nH]c(=O)[nH]c2cc1C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C12H15N3O5S MW 313.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H15N3O5S/c1-7-5-8-9(15-12(18)14-8)6-10(7)21(19,20)13-4-2-3-11(16)17/h5-6,13H,2-4H2,1H3,(H,16,17)(H2,14,15,18)InChIKey
ICEPFQUJYUGSDM-UHFFFAOYSA-NSynonyms
4(((6methyl2oxo23dihydro1Hbenzimidazol5yl)sulfonyl)amino)butanoicacid
4((6methyl2oxo13dihydrobenzimidazol5yl)sulfonylamino)butanoicacid
CC1=CC2=C(C=C1S(=O)(=O)NCCCC(=O)O)NC(=O)N2
InChI=1SC12H15N3O5Sc17589(1512(18)148)610(7)21(1920)1342311(16)17h5613H24H21H3(H1617)(H2141518)
MFCD10046205
OC(=O)CCCNS(=O)(=O)c1cc2(nH)c(=O)(nH)c2cc1C
ZINC000011635242
ZINC11635242
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