Vitas-M small molecule compound

2-[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]-N-(tetrahydro-2H-pyran-4-ylmethyl)acetamide

Catalog ID
STL538376
SMILES O=C(CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2)NCC1CCOCC1

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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 C20H25N3O4 MW 371.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O4/c24-18(21-12-14-7-10-27-11-8-14)13-23-16-5-2-1-4-15(16)19(25)22-9-3-6-17(22)20(23)26/h1-2,4-5,14,17H,3,6-13H2,(H,21,24)/t17-/m0/s1
InChIKey
ACQCIYWQXIJWIH-KRWDZBQOSA-N
Synonyms
1374565-91-9
(S)2(511dioxo231111atetrahydro1Hbenzo(e)pyrrolo(12a)(14)diazepin10(5H)yl)N((tetrahydro2Hpyran4yl)methyl)acetamide
1374565919
2((11aS)511dioxo231111atetrahydro1Hpyrrolo(21c)(14)benzodiazepin10(5H)yl)N(tetrahydro2Hpyran4ylmethyl)acetamide
2((6~(a)~(S))611dioxo6~(a)789tetrahydropyrrolo(21c)(14)benzodiazepin5yl)~(N)(oxan4ylmethyl)acetamide
71692279
InChI=1SC20H25N3O4c2418(2112147102711814)132316521415(16)19(25)2293617(22)20(23)26h12451417H3613H2(H2124)t17m0s1
O=C(CN1C(=O)(C@@H)2CCCN2C(=O)c2c1cccc2)NCC1CCOCC1
ZINC000072326079
ZINC72326079

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Available files

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