Vitas-M small molecule compound
(6aS,8R,9R)-8-(2,4-dimethylphenyl)-9-(phenylcarbonyl)-8,9-dihydropyrrolo[1,2-a][1,5]naphthyridine-7,7(6aH)-dicarbonitrile
Catalog ID
STK525730
SMILES N#CC1(C#N)[C@@H](c2ccc(cc2C)C)[C@@H](N2[C@H]1C=Cc1c2cccn1)C(=O)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 C28H22N4O MW 430.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22N4O/c1-18-10-11-21(19(2)15-18)25-26(27(33)20-7-4-3-5-8-20)32-23-9-6-14-31-22(23)12-13-24(32)28(25,16-29)17-30/h3-15,24-26H,1-2H3/t24-,25-,26+/m0/s1InChIKey
WKIDODGXOYHSOE-KKUQBAQOSA-NSynonyms
302333-66-0(6aS8R9R)8(24dimethylphenyl)9(phenylcarbonyl)89dihydropyrrolo(12a)(15)naphthyridine77(6aH)dicarbonitrile
(6aS8R9R)9benzoyl8(24dimethylphenyl)89dihydro6aHpyrrolo(12a)(15)naphthyridine77dicarbonitrile
(6aS8R9R)9benzoyl8(24dimethylphenyl)89dihydropyrrolo(12a)(15)naphthyridine77(6aH)dicarbonitrile
302333660
CC1=CC(=C(C=C1)C2C(N3C(C2(C#N)C#N)C=CC4=C3C=CC=N4)C(=O)C5=CC=CC=C5)C
InChI=1SC28H22N4Oc118101121(19(2)1518)2526(27(33)207435820)322396143122(23)121324(32)28(251629)1730h3152426H12H3t242526+m0s1
MFCD18241549
N#CC1(C#N)(C@@H)(c2ccc(cc2C)C)(C@@H)(N2(C@H)1C=Cc1c2cccn1)C(=O)c1ccccc1
ZINC000008926015
ZINC08926015
ZINC8926015
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