Vitas-M small molecule compound
(3aR,4S,9aR,9bS)-2-(4-methylphenyl)-1,3-dioxo-4-(phenylcarbonyl)-2,3,3a,4,9a,9b-hexahydro-1H-pyrrolo[3,4-a]indolizine-8-carbonitrile
Catalog ID
STK543320
SMILES N#CC1=C[C@H]2N(C=C1)[C@@H]([C@H]1[C@@H]2C(=O)N(C1=O)c1ccc(cc1)C)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 C25H19N3O3 MW 409.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19N3O3/c1-15-7-9-18(10-8-15)28-24(30)20-19-13-16(14-26)11-12-27(19)22(21(20)25(28)31)23(29)17-5-3-2-4-6-17/h2-13,19-22H,1H3/t19-,20-,21-,22+/m1/s1InChIKey
QXAZVKPNPDQSMN-YSFYHYPLSA-NSynonyms
1214633-39-2(3aR4S9aR9bS)2(4methylphenyl)13dioxo4(phenylcarbonyl)233a49a9bhexahydro1Hpyrrolo(34a)indolizine8carbonitrile
(3aR4S9aR9bS)4benzoyl13dioxo2(ptolyl)233a49a9bhexahydro1Hpyrrolo(34a)indolizine8carbonitrile
(3AR4S9AR9BS)4BENZOYL2(4METHYLPHENYL)13DIOXO3A49A9BTETRAHYDROPYRROLO(34A)INDOLIZINE8CARBONITRILE
1214633392
CC1=CC=C(C=C1)N2C(=O)C3C4C=C(C=CN4C(C3C2=O)C(=O)C5=CC=CC=C5)C#N
InChI=1SC25H19N3O3c1157918(10815)2824(30)20191316(1426)111227(19)22(21(20)25(28)31)23(29)175324617h2131922H1H3t19202122+m1s1
MFCD18242070
N#CC1=C(C@H)2N(C=C1)(C@@H)((C@H)1(C@@H)2C(=O)N(C1=O)c1ccc(cc1)C)C(=O)c1ccccc1
ZINC000020081219
ZINC20081219
Check stock
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Check stock on Vitas-MAvailable files
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