Vitas-M small molecule compound
11-(2-chlorophenyl)-10-hexanoyl-3-(4-methylphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL444596
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccccc1Cl)C(=O)CC(C2)c1ccc(cc1)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 C32H33ClN2O2 MW 513.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H33ClN2O2/c1-3-4-5-14-30(37)35-28-13-9-8-12-26(28)34-27-19-23(22-17-15-21(2)16-18-22)20-29(36)31(27)32(35)24-10-6-7-11-25(24)33/h6-13,15-18,23,32,34H,3-5,14,19-20H2,1-2H3InChIKey
JRDSMGABDMROBV-UHFFFAOYSA-NSynonyms
11(2chlorophenyl)10hexanoyl3(4methylphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(2chlorophenyl)5hexanoyl9(4methylphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)C)NC4=CC=CC=C41)C5=CC=CC=C5Cl
InChI=1SC32H33ClN2O2c13451430(37)352813981226(28)34271923(22171521(2)161822)2029(36)31(27)32(35)2410671125(24)33h6131518233234H35141920H212H3
MFCD03488639
ZINC000009011984
ZINC000009011987
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