Vitas-M small molecule compound

(3aS,6aS)-5-(4-methylphenyl)-3-(pyrazin-2-ylcarbonyl)-3a,6a-dihydropyrrolo[3,4-c]pyrazole-4,6(1H,5H)-dione

Catalog ID
STL525840
SMILES Cc1ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)C(=NN2)C(=O)c1cnccn1

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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 C17H13N5O3 MW 335.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O3/c1-9-2-4-10(5-3-9)22-16(24)12-13(20-21-14(12)17(22)25)15(23)11-8-18-6-7-19-11/h2-8,12,14,21H,1H3/t12-,14+/m1/s1
InChIKey
HXIGSLWCINYCRJ-OCCSQVGLSA-N
Synonyms
955971-98-9
(3~(a)~(S)6~(a)~(S))5(4methylphenyl)3(pyrazine2carbonyl)3~(a)6~(a)dihydro1~(H)pyrrolo(34c)pyrazole46dione
(3aS6aS)3(pyrazine2carbonyl)5(ptolyl)16adihydropyrrolo(34c)pyrazole46(3aH5H)dione
(3aS6aS)5(4methylphenyl)3(pyrazin2ylcarbonyl)3a6adihydropyrrolo(34c)pyrazole46(1H5H)dione
(3AS6AS)5(4METHYLPHENYL)3(PYRAZINE2CARBONYL)3A6ADIHYDRO1HPYRROLO(34C)PYRAZOLE46DIONE
928732
955971989
Cc1ccc(cc1)N1C(=O)(C@@H)2(C@H)(C1=O)C(=NN2)C(=O)c1cnccn1
InChI=1SC17H13N5O3c192410(539)2216(24)1213(202114(12)17(22)25)15(23)11818671911h28121421H1H3t1214+m1s1
MFCD01082401
ZINC000016029866
ZINC16029866

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Available files

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