Vitas-M small molecule compound
10-acetyl-11-(4-methoxyphenyl)-3-(2-propoxyphenyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL169449
SMILES CCCOc1ccccc1C1CC(=O)C2=C(C1)Nc1ccccc1N(C2c1ccc(cc1)OC)C(=O)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 C31H32N2O4 MW 496.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O4/c1-4-17-37-29-12-8-5-9-24(29)22-18-26-30(28(35)19-22)31(21-13-15-23(36-3)16-14-21)33(20(2)34)27-11-7-6-10-25(27)32-26/h5-16,22,31-32H,4,17-19H2,1-3H3InChIKey
PJBRAPMNULBSBF-UHFFFAOYSA-NSynonyms
10acetyl11(4methoxyphenyl)3(2propoxyphenyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
5acetyl6(4methoxyphenyl)9(2propoxyphenyl)891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCCOC1=CC=CC=C1C2CC3=C(C(N(C4=CC=CC=C4N3)C(=O)C)C5=CC=C(C=C5)OC)C(=O)C2
InChI=1SC31H32N2O4c141737291285924(29)22182630(28(35)1922)31(21131523(363)161421)33(20(2)34)2711761025(27)3226h516223132H41719H213H3
MFCD01955317
ZINC000008445111
ZINC000008445114
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