Vitas-M small molecule compound
4,7-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}-1H-indole-2-carboxamide
Catalog ID
STL578840
SMILES COc1ccc(c2c1[nH]c(c2)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)OC
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We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C24H28N4O4 MW 436.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O4/c1-31-20-6-7-21(32-2)23-17(20)11-18(26-23)24(30)25-8-9-27-12-15-10-16(14-27)19-4-3-5-22(29)28(19)13-15/h3-7,11,15-16,26H,8-10,12-14H2,1-2H3,(H,25,30)/t15-,16+/m1/s1InChIKey
BPKSEEDIOLMMOM-CVEARBPZSA-NSynonyms
47dimethoxyN(2((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)ethyl)1Hindole2carboxamide
47dimethoxyN(2((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)ethyl)1Hindole2carboxamide
COc1ccc(c2c1(nH)c(c2)C(=O)NCCN1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)OC
InChI=1SC24H28N4O4c131206721(322)2317(20)1118(2623)24(30)25892712151016(1427)1943522(29)28(19)1315h3711151626H8101214H212H3(H2530)t1516+m1s1
MFCD33397283
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