Vitas-M small molecule compound
N-[(1S)-1-(1-methyl-1H-benzimidazol-2-yl)ethyl]-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Catalog ID
STL542108
SMILES O=C1N[C@@H]2[C@H](N1)[C@@H](SC2)CCCCC(=O)N[C@H](c1nc2c(n1C)cccc2)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 C20H27N5O2S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N5O2S/c1-12(19-22-13-7-3-4-8-15(13)25(19)2)21-17(26)10-6-5-9-16-18-14(11-28-16)23-20(27)24-18/h3-4,7-8,12,14,16,18H,5-6,9-11H2,1-2H3,(H,21,26)(H2,23,24,27)/t12-,14-,16-,18-/m0/s1InChIKey
CQYGFEPQLVEZFD-GKEYINFOSA-NSynonyms
1574380-63-41574380634
5((3~(a)~(S)4~(S)6~(a)~(R))2oxo133~(a)466~(a)hexahydrothieno(34d)imidazol4yl)~(N)((1~(S))1(1methylbenzimidazol2yl)ethyl)pentanamide
75491238
InChI=1SC20H27N5O2Sc112(192213734815(13)25(19)2)2117(26)10659161814(112816)2320(27)2418h347812141618H56911H212H3(H2126)(H2232427)t12141618m0s1
N((1S)1(1methyl1Hbenzimidazol2yl)ethyl)5((3aS4S6aR)2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
N((S)1(1methyl1Hbenzo(d)imidazol2yl)ethyl)5((3aS4S6aR)2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
O=C1N(C@@H)2(C@H)(N1)(C@@H)(SC2)CCCCC(=O)N(C@H)(c1nc2c(n1C)cccc2)C
ZINC000096221183
ZINC96221183
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