Vitas-M small molecule compound
6,7-dimethoxy-N-{2-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]ethyl}-2,4-dihydroindeno[1,2-c]pyrazole-3-carboxamide
Catalog ID
STL579195
SMILES COc1cc2c(cc1OC)Cc1c2n[nH]c1C(=O)NCCN1C[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 C26H29N5O4 MW 475.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N5O4/c1-34-21-10-16-9-19-24(18(16)11-22(21)35-2)28-29-25(19)26(33)27-6-7-30-12-15-8-17(14-30)20-4-3-5-23(32)31(20)13-15/h3-5,10-11,15,17H,6-9,12-14H2,1-2H3,(H,27,33)(H,28,29)/t15-,17+/m1/s1InChIKey
BBVBYPZTCSEENU-WBVHZDCISA-NSynonyms
67dimethoxyN(2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)ethyl)14dihydroindeno(12c)pyrazole3carboxamide
67dimethoxyN(2((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)ethyl)24dihydroindeno(12c)pyrazole3carboxamide
COc1cc2c(cc1OC)Cc1c2(nH)nc1C(=O)NCCN1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC26H29N5O4c13421101691924(18(16)1122(21)352)282925(19)26(33)2767301215817(1430)2043523(32)31(20)1315h3510111517H691214H212H3(H2733)(H2829)t1517+m1s1
MFCD33397541
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