Vitas-M small molecule compound
(4aS,4bR,7aS,8R)-6-(naphthalen-2-yl)-8-[(3-nitrophenyl)carbonyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK552345
SMILES O=C1N(c2ccc3c(c2)cccc3)C(=O)[C@@H]2[C@H]1[C@@H](N1[C@H]2C=CC=N1)C(=O)c1cccc(c1)[N+](=O)[O-]
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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 C26H18N4O5 MW 466.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18N4O5/c31-24(17-7-3-8-19(14-17)30(34)35)23-22-21(20-9-4-12-27-29(20)23)25(32)28(26(22)33)18-11-10-15-5-1-2-6-16(15)13-18/h1-14,20-23H/t20-,21-,22-,23+/m0/s1InChIKey
VJSXAFRWPGYHOJ-CWBXHPNXSA-NSynonyms
1013793-28-6(3aS4R9aS9bR)2naphthalen2yl4(3nitrobenzoyl)3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4aS4bR7aS8R)6(naphthalen2yl)8((3nitrophenyl)carbonyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4aS4bR7aS8R)6(naphthalen2yl)8(3nitrobenzoyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
1013793286
C1=CC=C2C=C(C=CC2=C1)N3C(=O)C4C5C=CC=NN5C(C4C3=O)C(=O)C6=CC(=CC=C6)(N+)(=O)(O)
InChI=1SC26H18N4O5c3124(1773819(1417)30(34)35)232221(2094122729(20)23)25(32)28(26(22)33)18111015512616(15)1318h1142023Ht20212223+m0s1
MFCD18242643
O=C1N(c2ccc3c(c2)cccc3)C(=O)(C@@H)2(C@H)1(C@@H)(N1(C@H)2C=CC=N1)C(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000018175894
ZINC18175894
Check stock
See real-time availability and sample size for STK552345 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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