Vitas-M small molecule compound
10-acetyl-3-phenyl-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK031653
SMILES O=C1CC(CC2=C1C(c1cccs1)N(C(=O)C)c1c(N2)cccc1)c1ccccc1
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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 C25H22N2O2S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O2S/c1-16(28)27-21-11-6-5-10-19(21)26-20-14-18(17-8-3-2-4-9-17)15-22(29)24(20)25(27)23-12-7-13-30-23/h2-13,18,25-26H,14-15H2,1H3InChIKey
FLANDASYZIJADQ-UHFFFAOYSA-NSynonyms
10acetyl3phenyl11(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5acetyl9phenyl6thiophen2yl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC(=O)N1C(C2=C(CC(CC2=O)C3=CC=CC=C3)NC4=CC=CC=C41)C5=CC=CS5
InChI=1SC25H22N2O2Sc116(28)272111651019(21)26201418(178324917)1522(29)24(20)25(27)23127133023h213182526H1415H21H3
MFCD02212481
O=C1CC(CC2=C1C(c1cccs1)N(C(=O)C)c1c(N2)cccc1)c1ccccc1
STK031653
ZINC000001200617
ZINC000001200627
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