Vitas-M small molecule compound
3-(4-tert-butylphenyl)-10-(2-methylpropanoyl)-11-(pyridin-4-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK679230
SMILES CC(C(=O)N1c2ccccc2NC2=C(C1c1ccncc1)C(=O)CC(C2)c1ccc(cc1)C(C)(C)C)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 C32H35N3O2 MW 493.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H35N3O2/c1-20(2)31(37)35-27-9-7-6-8-25(27)34-26-18-23(21-10-12-24(13-11-21)32(3,4)5)19-28(36)29(26)30(35)22-14-16-33-17-15-22/h6-17,20,23,30,34H,18-19H2,1-5H3InChIKey
FUQXYRNPIYZOII-UHFFFAOYSA-NSynonyms
3(4tertbutylphenyl)10(2methylpropanoyl)11(pyridin4yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4tertbutylphenyl)5(2methylpropanoyl)6pyridin4yl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CC(C)C(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)C(C)(C)C)NC4=CC=CC=C41)C5=CC=NC=C5
InChI=1SC32H35N3O2c120(2)31(37)3527976825(27)34261823(21101224(131121)32(34)5)1928(36)29(26)30(35)22141633171522h61720233034H1819H215H3
MFCD03408865
ZINC000000719214
ZINC000000719217
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