Vitas-M small molecule compound

3-{[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]amino}-4-[(pyridin-4-ylmethyl)amino]cyclobut-3-ene-1,2-dione

Catalog ID
STL536374
SMILES O=C1C(=O)C(=C1NCc1ccncc1)NC[C@@H]1CCCN2[C@@H]1CCCC2

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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 C20H26N4O2 MW 354.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O2/c25-19-17(22-12-14-6-8-21-9-7-14)18(20(19)26)23-13-15-4-3-11-24-10-2-1-5-16(15)24/h6-9,15-16,22-23H,1-5,10-13H2/t15-,16+/m0/s1
InChIKey
LPLQMQYVGORXEX-JKSUJKDBSA-N
Synonyms
1380576-02-2
1380576022
3((((1S9AR)OCTAHYDRO1HQUINOLIZIN1YL)METHYL)AMINO)4((PYRIDIN4YLMETHYL)AMINO)CYCLOBUT3ENE12DIONE
3(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methylamino)4(pyridin4ylmethylamino)cyclobut3ene12dione
3(((1S9aR)octahydro2Hquinolizin1ylmethyl)amino)4((pyridin4ylmethyl)amino)cyclobut3ene12dione
56723794
InChI=1SC20H26N4O2c251917(22121468219714)18(20(19)26)2313154311241021516(15)24h6915162223H151013H2t1516+m0s1
O=C1C(=O)C(=C1NCc1ccncc1)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000100795089
ZINC100795089

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Available files

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