Vitas-M small molecule compound

(2'S,3S,3'S,10b'R)-3'-[(4-methoxyphenyl)carbonyl]-2'-[(4-propylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one

Catalog ID
STK598409
SMILES CCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2

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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 C37H32N2O4 MW 568.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H32N2O4/c1-3-8-23-13-15-25(16-14-23)33(40)31-32(34(41)26-17-19-27(43-2)20-18-26)39-22-21-24-9-4-5-10-28(24)35(39)37(31)29-11-6-7-12-30(29)38-36(37)42/h4-7,9-22,31-32,35H,3,8H2,1-2H3,(H,38,42)/t31-,32-,35+,37+/m0/s1
InChIKey
JOSUZPZEYPNQHK-UMKORLBGSA-N
Synonyms
1212173-89-1
(1S2S3S10bR)3(4methoxybenzoyl)2(4propylbenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3((4methoxyphenyl)carbonyl)2((4propylphenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3(4methoxybenzoyl)2(4propylbenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212173891
CCCC1=CC=C(C=C1)C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=C(C=C7)OC
CCCc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2ccc(cc2)OC)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC37H32N2O4c13823131525(161423)33(40)3132(34(41)26171927(432)201826)392221249451028(24)35(39)37(31)2911671230(29)3836(37)42h47922313235H38H212H3(H3842)t313235+37+m0s1
MFCD18158555
ZINC000101671202
ZINC101671202

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Available files

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