Vitas-M small molecule compound
(1S,5S)-3-[(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)sulfonyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL533612
SMILES O=c1oc2c([nH]1)ccc(c2)S(=O)(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1
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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 C18H17N3O5S MW 387.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O5S/c22-17-3-1-2-15-12-6-11(9-21(15)17)8-20(10-12)27(24,25)13-4-5-14-16(7-13)26-18(23)19-14/h1-5,7,11-12H,6,8-10H2,(H,19,23)/t11-,12+/m0/s1InChIKey
DMOPJLCDXIUPCO-NWDGAFQWSA-NSynonyms
(1S5S)3((2oxo23dihydro13benzoxazol6yl)sulfonyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
6(((1R5R)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)sulfonyl)benzo(d)oxazol2(3H)one
InChI=1SC18H17N3O5Sc22173121512611(921(15)17)820(1012)27(2425)13451416(713)2618(23)1914h1571112H6810H2(H1923)t1112+m0s1
MFCD05674867
O=c1oc2c((nH)1)ccc(c2)S(=O)(=O)N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
ZINC000002120390
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