Vitas-M small molecule compound
11-(2-chlorophenyl)-3,3-dimethyl-10-(2-phenylethyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK164652
SMILES O=C1CC(C)(C)CC2=C1C(N(CCc1ccccc1)c1c(N2)cccc1)c1ccccc1Cl
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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 C29H29ClN2O MW 457.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29ClN2O/c1-29(2)18-24-27(26(33)19-29)28(21-12-6-7-13-22(21)30)32(17-16-20-10-4-3-5-11-20)25-15-9-8-14-23(25)31-24/h3-15,28,31H,16-19H2,1-2H3InChIKey
UXFLIHCXUGTRJJ-UHFFFAOYSA-NSynonyms
11(2chlorophenyl)33dimethyl10(2phenylethyl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
6(2chlorophenyl)99dimethyl5(2phenylethyl)681011tetrahydrobenzo(b)(14)benzodiazepin7one
CC1(CC2=C(C(N(C3=CC=CC=C3N2)CCC4=CC=CC=C4)C5=CC=CC=C5Cl)C(=O)C1)C
InChI=1SC29H29ClN2Oc129(2)182427(26(33)1929)28(2112671322(21)30)32(171620104351120)2515981423(25)3124h3152831H1619H212H3
MFCD03759848
ZINC000009846566
ZINC000009846567
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