Vitas-M small molecule compound
2-[(2R,6'R)-7-chloro-4,6-dimethoxy-2'-(4-methoxyphenyl)-6'-methyl-3,4'-dioxo-6',7'-dihydro-3H,4'H-2,5'-spirobi[[1]benzofuran]-3'-yl]-N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]acetamide
Catalog ID
STL561921
SMILES COc1ccc(cc1)c1oc2c(c1CC(=O)NCC(c1ccc(cc1)OC)N(C)C)C(=O)[C@]1([C@@H](C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC
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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 C38H39ClN2O9 MW 703.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H39ClN2O9/c1-20-16-28-31(36(43)38(20)37(44)32-27(47-6)18-29(48-7)33(39)35(32)50-38)25(34(49-28)22-10-14-24(46-5)15-11-22)17-30(42)40-19-26(41(2)3)21-8-12-23(45-4)13-9-21/h8-15,18,20,26H,16-17,19H2,1-7H3,(H,40,42)/t20-,26?,38+/m1/s1InChIKey
WNZSORXNDARHOL-NHSQCNQFSA-NSynonyms
145705275
2((2R6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi((1)benzofuran)3yl)N(2(dimethylamino)2(4methoxyphenyl)ethyl)acetamide
2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi(benzofuran)3yl)N(2(dimethylamino)2(4methoxyphenyl)ethyl)acetamide
2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxospiro(1benzofuran2567dihydro1benzofuran)3yl)N(2(dimethylamino)2(4methoxyphenyl)ethyl)acetamide
COc1ccc(cc1)c1oc2c(c1CC(=O)NCC(c1ccc(cc1)OC)N(C)C)C(=O)(C@)1((C@@H)(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC
InChI=1SC38H39ClN2O9c120162831(36(43)38(20)37(44)3227(476)1829(487)33(39)35(32)5038)25(34(4928)22101424(465)151122)1730(42)401926(41(2)3)2181223(454)13921h815182026H161719H217H3(H4042)t2026?38+m1s1
MFCD32650979
ZINC001848443499
ZINC001848443500
Check stock
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