Vitas-M small molecule compound
(4aR,4bS,7aR,8S)-8-[(4-fluorophenyl)carbonyl]-6-(naphthalen-1-yl)-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK556637
SMILES Fc1ccc(cc1)C(=O)[C@H]1N2N=CC=C[C@@H]2[C@@H]2[C@H]1C(=O)N(C2=O)c1cccc2c1cccc2
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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 C26H18FN3O3 MW 439.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18FN3O3/c27-17-12-10-16(11-13-17)24(31)23-22-21(20-9-4-14-28-30(20)23)25(32)29(26(22)33)19-8-3-6-15-5-1-2-7-18(15)19/h1-14,20-23H/t20-,21-,22-,23+/m1/s1InChIKey
OXBRXNAUVDHRIQ-ODAXIHTASA-NSynonyms
1013792-63-6(3aR4S9aR9bS)4(4fluorobenzoyl)2naphthalen1yl3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4aR4bS7aR8S)8((4fluorophenyl)carbonyl)6(naphthalen1yl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4aR4bS7aR8S)8(4fluorobenzoyl)6(naphthalen1yl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
1013792636
C1=CC=C2C(=C1)C=CC=C2N3C(=O)C4C5C=CC=NN5C(C4C3=O)C(=O)C6=CC=C(C=C6)F
Fc1ccc(cc1)C(=O)(C@H)1N2N=CC=C(C@@H)2(C@@H)2(C@H)1C(=O)N(C2=O)c1cccc2c1cccc2
InChI=1SC26H18FN3O3c2717121016(111317)24(31)232221(2094142830(20)23)25(32)29(26(22)33)1983615512718(15)19h1142023Ht20212223+m1s1
MFCD18242957
ZINC000013514363
ZINC13514363
Check stock
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Check stock on Vitas-MAvailable files
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