Vitas-M small molecule compound
(1S,5R)-3-[2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-4-(methylsulfanyl)butanoyl]decahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one
Catalog ID
STL579169
SMILES CSCCC(n1c(O)nc2c(c1=O)cccc2)C(=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 C24H30N4O4S MW 470.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H30N4O4S/c1-33-10-9-20(28-22(30)17-5-2-3-6-18(17)25-24(28)32)23(31)26-12-15-11-16(14-26)19-7-4-8-21(29)27(19)13-15/h2-3,5-6,15-16,19-20H,4,7-14H2,1H3,(H,25,32)/t15-,16+,19?,20?/m1/s1InChIKey
AEQBECZXKVBLNW-ZNVHBHFFSA-NSynonyms
(1S5R)3(2(2hydroxy4oxoquinazolin3(4H)yl)4(methylsulfanyl)butanoyl)decahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC24H30N4O4Sc13310920(2822(30)17523618(17)2524(28)32)23(31)2612151116(1426)1974821(29)27(19)1315h235615161920H4714H21H3(H2532)t1516+19?20?m1s1
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