Vitas-M small molecule compound
N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-[(3aS,4S,6aR)-2-oxohexahydro-1H-thieno[3,4-d]imidazol-4-yl]pentanamide
Catalog ID
STL536426
SMILES O=C(Nc1ccc2c(c1)OCCCO2)CCCC[C@@H]1SC[C@H]2[C@@H]1NC(=O)N2
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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 C19H25N3O4S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O4S/c23-17(20-12-6-7-14-15(10-12)26-9-3-8-25-14)5-2-1-4-16-18-13(11-27-16)21-19(24)22-18/h6-7,10,13,16,18H,1-5,8-9,11H2,(H,20,23)(H2,21,22,24)/t13-,16-,18-/m0/s1InChIKey
JPTGACNJCHTYIE-OWQGQXMQSA-NSynonyms
32338797
5((3~(a)~(S)4~(S)6~(a)~(R))2oxo133~(a)466~(a)hexahydrothieno(34d)imidazol4yl)~(N)(34dihydro2~(H)15benzodioxepin7yl)pentanamide
InChI=1SC19H25N3O4Sc2317(2012671415(1012)269382514)5214161813(112716)2119(24)2218h6710131618H158911H2(H2023)(H2212224)t131618m0s1
N(34dihydro2H15benzodioxepin7yl)5((3aS4S6aR)2oxohexahydro1Hthieno(34d)imidazol4yl)pentanamide
N(34DIHYDRO2HBENZO(B)(14)DIOXEPIN7YL)5((3AS4S6AR)2OXOHEXAHYDRO1HTHIENO(34D)IMIDAZOL4YL)PENTANAMIDE
O=C(Nc1ccc2c(c1)OCCCO2)CCCC(C@@H)1SC(C@H)2(C@@H)1NC(=O)N2
ZINC000025029920
ZINC25029920
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