Vitas-M small molecule compound
N-[(11aS)-11-hydroxy-5-oxo-2,3,5,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-7-yl]-6-(4-oxoquinazolin-3(4H)-yl)hexanamide
Catalog ID
STL539517
SMILES O=C(Nc1ccc2c(c1)C(=O)N1CCC[C@H]1C(=N2)O)CCCCCn1cnc2c(c1=O)cccc2
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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 C26H27N5O4 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O4/c32-23(10-2-1-5-13-30-16-27-20-8-4-3-7-18(20)25(30)34)28-17-11-12-21-19(15-17)26(35)31-14-6-9-22(31)24(33)29-21/h3-4,7-8,11-12,15-16,22H,1-2,5-6,9-10,13-14H2,(H,28,32)(H,29,33)/t22-/m0/s1InChIKey
KJKSXQMPWGSHMP-QFIPXVFZSA-NSynonyms
1574466-80-0~(N)((6~(a)~(S))611dioxo6~(a)789tetrahydro5~(H)pyrrolo(21c)(14)benzodiazepin2yl)6(4oxoquinazolin3yl)hexanamide
1574466800
71826606
InChI=1SC26H27N5O4c3223(102151330162720843718(20)25(30)34)281711122119(1517)26(35)31146922(31)24(33)2921h34781112151622H12569101314H2(H2832)(H2933)t22m0s1
N((11aS)11hydroxy5oxo23511atetrahydro1Hpyrrolo(21c)(14)benzodiazepin7yl)6(4oxoquinazolin3(4H)yl)hexanamide
ZINC000096114902
ZINC96114902
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