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-(furan-2-yl)-2-(morpholin-4-yl)ethyl]acetamide

Catalog ID
STL561689
SMILES COc1ccc(cc1)c1oc2c(c1CC(=O)NCC(c1ccco1)N1CCOCC1)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 C37H37ClN2O10 MW 705.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H37ClN2O10/c1-20-16-27-30(35(42)37(20)36(43)31-26(45-3)18-28(46-4)32(38)34(31)50-37)23(33(49-27)21-7-9-22(44-2)10-8-21)17-29(41)39-19-24(25-6-5-13-48-25)40-11-14-47-15-12-40/h5-10,13,18,20,24H,11-12,14-17,19H2,1-4H3,(H,39,41)/t20-,24?,37+/m1/s
InChIKey
AZFMXGJLUYGMOX-ULPDQCOSSA-N
Synonyms

145705046
2((2R6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi((1)benzofuran)3yl)N(2(furan2yl)2(morpholin4yl)ethyl)acetamide
2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi(benzofuran)3yl)N(2(furan2yl)2morpholinoethyl)acetamide
2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxospiro(1benzofuran2567dihydro1benzofuran)3yl)N(2(furan2yl)2morpholin4ylethyl)acetamide
COc1ccc(cc1)c1oc2c(c1CC(=O)NCC(c1ccco1)N1CCOCC1)C(=O)(C@)1((C@@H)(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC
InChI=1SC37H37ClN2O10c120162730(35(42)37(20)36(43)3126(453)1828(464)32(38)34(31)5037)23(33(4927)217922(442)10821)1729(41)391924(2565134825)40111447151240h51013182024H1112141719H214H3(H3941)t2024?37+m1s1
MFCD32650754
ZINC001848442573
ZINC001848442574

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Available files

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