Vitas-M small molecule compound
3-(thiophen-2-yl)-11-(2,3,4-trimethoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK326250
SMILES COc1ccc(c(c1OC)OC)C1Nc2ccccc2NC2=C1C(=O)CC(C2)c1cccs1
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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 C26H26N2O4S MW 462.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O4S/c1-30-21-11-10-16(25(31-2)26(21)32-3)24-23-19(27-17-7-4-5-8-18(17)28-24)13-15(14-20(23)29)22-9-6-12-33-22/h4-12,15,24,27-28H,13-14H2,1-3H3InChIKey
QBFAMPIUGRFWST-UHFFFAOYSA-NSynonyms
3(thiophen2yl)11(234trimethoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9thiophen2yl6(234trimethoxyphenyl)56891011hexahydrobenzo(b)(14)benzodiazepin7one
COC1=C(C(=C(C=C1)C2C3=C(CC(CC3=O)C4=CC=CS4)NC5=CC=CC=C5N2)OC)OC
InChI=1SC26H26N2O4Sc13021111016(25(312)26(21)323)242319(2717745818(17)2824)1315(1420(23)29)2296123322h41215242728H1314H213H3
MFCD03146461
ZINC000000720703
ZINC000000720706
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