Vitas-M small molecule compound

(2'R,3'R)-3'-[(4-methoxyphenyl)carbonyl]-2'-phenyl-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione

Catalog ID
STK549751
SMILES COc1ccc(cc1)C(=O)[C@@H]1N2N=Cc3c(C2[C@@]2([C@H]1c1ccccc1)C(=O)c1c(C2=O)cccc1)cccc3

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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 C33H24N2O4 MW 512.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H24N2O4/c1-39-23-17-15-21(16-18-23)29(36)28-27(20-9-3-2-4-10-20)33(31(37)25-13-7-8-14-26(25)32(33)38)30-24-12-6-5-11-22(24)19-34-35(28)30/h2-19,27-28,30H,1H3/t27-,28+,30?/m0/s1
InChIKey
MJHHYGSAXPTSMW-VXLAJHQFSA-N
Synonyms
1177901-94-8
(2R3R)3((4methoxyphenyl)carbonyl)2phenyl23dihydro10bHspiro(indene21pyrrolo(21a)phthalazine)13dione
(2R3R)3(4methoxybenzoyl)2phenyl310bdihydro2Hspiro(indene21pyrrolo(21a)phthalazine)13dione
(2R3R)3(4methoxybenzoyl)2phenylspiro(310bdihydro2Hpyrrolo(21a)phthalazine12indene)13dione
1177901948
COC1=CC=C(C=C1)C(=O)C2C(C3(C4N2N=CC5=CC=CC=C45)C(=O)C6=CC=CC=C6C3=O)C7=CC=CC=C7
COc1ccc(cc1)C(=O)(C@@H)1N2N=Cc3c(C2(C@@)2((C@H)1c1ccccc1)C(=O)c1c(C2=O)cccc1)cccc3
COc1ccc(cc1)C(=O)(C@@H)1N2N=Cc3c(C2C2((C@H)1c1ccccc1)C(=O)c1c(C2=O)cccc1)cccc3
InChI=1SC33H24N2O4c13923171521(161823)29(36)2827(2093241020)33(31(37)2513781426(25)32(33)38)302412651122(24)193435(28)30h219272830H1H3t2728+30?m0s1
ZINC000008743305
ZINC000100990900

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Available files

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