Vitas-M small molecule compound
ethyl 4-({[(11aS)-5,11-dioxo-2,3,11,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-10(5H)-yl]acetyl}amino)benzoate
Catalog ID
STL565777
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CN1C(=O)[C@@H]2CCCN2C(=O)c2c1cccc2
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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 C23H23N3O5 MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O5/c1-2-31-23(30)15-9-11-16(12-10-15)24-20(27)14-26-18-7-4-3-6-17(18)21(28)25-13-5-8-19(25)22(26)29/h3-4,6-7,9-12,19H,2,5,8,13-14H2,1H3,(H,24,27)/t19-/m0/s1InChIKey
ZHDLLLGOEQZUSA-IBGZPJMESA-NSynonyms
1014079-99-2(S)ethyl4(2(511dioxo231111atetrahydro1Hbenzo(e)pyrrolo(12a)(14)diazepin10(5H)yl)acetamido)benzoate
1014079992
17572181
CCOC(=O)c1ccc(cc1)NC(=O)CN1C(=O)(C@@H)2CCCN2C(=O)c2c1cccc2
ethyl4((((11aS)511dioxo231111atetrahydro1Hpyrrolo(21c)(14)benzodiazepin10(5H)yl)acetyl)amino)benzoate
ethyl4((2((6aS)611dioxo6a789tetrahydropyrrolo(21c)(14)benzodiazepin5yl)acetyl)amino)benzoate
InChI=1SC23H23N3O5c123123(30)1591116(121015)2420(27)142618743617(18)21(28)25135819(25)22(26)29h346791219H2581314H21H3(H2427)t19m0s1
ZINC000012902084
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