Vitas-M small molecule compound

(8S,8aR,11aS,11bS)-10-(naphthalen-1-yl)-8-(phenylcarbonyl)-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]phthalazine-9,11(8aH,10H)-dione

Catalog ID
STK543922
SMILES O=C([C@@H]1[C@H]2[C@@H]([C@@H]3N1N=Cc1c3cccc1)C(=O)N(C2=O)c1cccc2c1cccc2)c1ccccc1

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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 C30H21N3O3 MW 471.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H21N3O3/c34-28(19-10-2-1-3-11-19)27-25-24(26-22-15-7-5-12-20(22)17-31-33(26)27)29(35)32(30(25)36)23-16-8-13-18-9-4-6-14-21(18)23/h1-17,24-27H/t24-,25+,26+,27-/m0/s1
InChIKey
ONCNJFOCAQRSCZ-YAOOYPAMSA-N
Synonyms
956938-22-0
(8S8aR11aS11bS)10(naphthalen1yl)8(phenylcarbonyl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
(8S8aR11aS11bS)8benzoyl10(naphthalen1yl)11a11bdihydro8Hpyrrolo(3434)pyrrolo(21a)phthalazine911(8aH10H)dione
956938220
C1=CC=C(C=C1)C(=O)C2C3C(C4N2N=CC5=CC=CC=C45)C(=O)N(C3=O)C6=CC=CC7=CC=CC=C76
InChI=1SC30H21N3O3c3428(19102131119)272524(262215751220(22)173133(26)27)29(35)32(30(25)36)2316813189461421(18)23h1172427Ht2425+26+27m0s1
MFCD18242114
O=C((C@@H)1(C@H)2(C@@H)((C@@H)3N1N=Cc1c3cccc1)C(=O)N(C2=O)c1cccc2c1cccc2)c1ccccc1
ZINC000017995995
ZINC17995995

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Available files

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