Vitas-M small molecule compound

(2'S,3'R)-2'-(2,4-dichlorophenyl)-3'-(phenylcarbonyl)-2',3'-dihydro-10b'H-spiro[indene-2,1'-pyrrolo[2,1-a]phthalazine]-1,3-dione

Catalog ID
STK548396
SMILES Clc1ccc(c(c1)Cl)[C@H]1[C@H](C(=O)c2ccccc2)N2C([C@@]31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2

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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 C32H20Cl2N2O3 MW 551.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H20Cl2N2O3/c33-20-14-15-24(25(34)16-20)26-27(28(37)18-8-2-1-3-9-18)36-29(21-11-5-4-10-19(21)17-35-36)32(26)30(38)22-12-6-7-13-23(22)31(32)39/h1-17,26-27,29H/t26-,27+,29?/m0/s1
InChIKey
LISIWFDMJWZKNI-ZDCXKQOISA-N
Synonyms

(2S3R)2(24dichlorophenyl)3(phenylcarbonyl)23dihydro10bHspiro(indene21pyrrolo(21a)phthalazine)13dione
(2S3R)3benzoyl2(24dichlorophenyl)310bdihydro2Hspiro(indene21pyrrolo(21a)phthalazine)13dione
(2S3R)3benzoyl2(24dichlorophenyl)spiro(310bdihydro2Hpyrrolo(21a)phthalazine12indene)13dione
C1=CC=C(C=C1)C(=O)C2C(C3(C4N2N=CC5=CC=CC=C45)C(=O)C6=CC=CC=C6C3=O)C7=C(C=C(C=C7)Cl)Cl
Clc1ccc(c(c1)Cl)(C@H)1(C@H)(C(=O)c2ccccc2)N2C((C@@)31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2
Clc1ccc(c(c1)Cl)(C@H)1(C@H)(C(=O)c2ccccc2)N2C(C31C(=O)c1c(C3=O)cccc1)c1ccccc1C=N2
InChI=1SC32H20Cl2N2O3c3320141524(25(34)1620)2627(28(37)188213918)3629(2111541019(21)173536)32(26)30(38)2212671323(22)31(32)39h117262729Ht2627+29?m0s1
ZINC000001872145
ZINC000102628271

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Available files

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