Vitas-M small molecule compound
N-[(1S)-1-(1H-benzimidazol-2-yl)-2-methylbutyl]-2-(1H-tetrazol-1-yl)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide
Catalog ID
STL568449
SMILES CC[C@@H]([C@@H](c1nc2c([nH]1)cccc2)NC(=O)c1c(sc2c1CCC2)n1cnnn1)C
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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 C21H23N7OS MW 421.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N7OS/c1-3-12(2)18(19-23-14-8-4-5-9-15(14)24-19)25-20(29)17-13-7-6-10-16(13)30-21(17)28-11-22-26-27-28/h4-5,8-9,11-12,18H,3,6-7,10H2,1-2H3,(H,23,24)(H,25,29)/t12-,18-/m0/s1InChIKey
AQSOPFLKFXKTRB-SGTLLEGYSA-NSynonyms
125462548
CC(C@H)((C@@H)(c1nc2c((nH)1)cccc2)NC(=O)c1c(sc2c1CCC2)n1cnnn1)C
InChI=1SC21H23N7OSc1312(2)18(192314845915(14)2419)2520(29)1713761016(13)3021(17)281122262728h4589111218H36710H212H3(H2324)(H2529)t1218m0s1
MFCD32653540
N((1S)1(1Hbenzimidazol2yl)2methylbutyl)2(1Htetrazol1yl)56dihydro4Hcyclopenta(b)thiophene3carboxamide
N((1S2S)1(1Hbenzimidazol2yl)2methylbutyl)2(tetrazol1yl)56dihydro4Hcyclopenta(b)thiophene3carboxamide
N((1S2S)1(1Hbenzo(d)imidazol2yl)2methylbutyl)2(1Htetrazol1yl)56dihydro4Hcyclopenta(b)thiophene3carboxamide
ZINC000583652496
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