Vitas-M small molecule compound
N-(3-acetylphenyl)-2-(5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl)acetamide
Catalog ID
STL472160
SMILES O=C(CN1C(=O)C2CCCN2C(=O)c2c1cccc2)Nc1cccc(c1)C(=O)C
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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 C22H21N3O4 MW 391.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O4/c1-14(26)15-6-4-7-16(12-15)23-20(27)13-25-18-9-3-2-8-17(18)21(28)24-11-5-10-19(24)22(25)29/h2-4,6-9,12,19H,5,10-11,13H2,1H3,(H,23,27)InChIKey
KNPHREGXHUAPLD-UHFFFAOYSA-NSynonyms
(S)N(3acetylphenyl)2(511dioxo231111atetrahydro1Hbenzo(e)pyrrolo(12a)(14)diazepin10(5H)yl)acetamide
CC(=O)C1=CC(=CC=C1)NC(=O)CN2C3=CC=CC=C3C(=O)N4CCCC4C2=O
InChI=1SC22H21N3O4c114(26)1564716(1215)2320(27)132518932817(18)21(28)241151019(24)22(25)29h24691219H5101113H21H3(H2327)
MFCD31751198
N(3acetylphenyl)2(511dioxo231111atetrahydro1Hpyrrolo(21c)(14)benzodiazepin10(5H)yl)acetamide
N(3acetylphenyl)2(611dioxo6a789tetrahydropyrrolo(21c)(14)benzodiazepin5yl)acetamide
O=C(CN1C(=O)(C@@H)2CCCN2C(=O)c2c1cccc2)Nc1cccc(c1)C(=O)C
ZINC000072325632
ZINC000212506549
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