Vitas-M small molecule compound

10-(1H-benzimidazol-2-ylmethyl)-3,3-dimethyl-11-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

Catalog ID
STK114067
SMILES O=C1CC(C)(C)CC2=C1C(c1ccccc1)N(Cc1nc3c([nH]1)cccc3)c1c(N2)cccc1

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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 C29H28N4O MW 448.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H28N4O/c1-29(2)16-23-27(25(34)17-29)28(19-10-4-3-5-11-19)33(24-15-9-8-14-22(24)30-23)18-26-31-20-12-6-7-13-21(20)32-26/h3-15,28,30H,16-18H2,1-2H3,(H,31,32)
InChIKey
LSFLZNUJDFQEQS-UHFFFAOYSA-N
Synonyms
517868-83-6
10((1Hbenzo(d)imidazol2yl)methyl)33dimethyl11phenyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10(1Hbenzimidazol2ylmethyl)33dimethyl11phenyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
10(BENZIMIDAZOL2YLMETHYL)33DIMETHYL11PHENYL234TRIHYDRO5H11HBENZO(B)BENZO(21F)14DIAZEPIN1ONE
5(1Hbenzimidazol2ylmethyl)99dimethyl6phenyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
517868836
CC1(CC2=C(C(N(C3=CC=CC=C3N2)CC4=NC5=CC=CC=C5N4)C6=CC=CC=C6)C(=O)C1)C
InChI=1SC29H28N4Oc129(2)162327(25(34)1729)28(19104351119)33(2415981422(24)3023)1826312012671321(20)3226h3152830H1618H212H3(H3132)
MFCD03778823
O=C1CC(C)(C)CC2=C1C(c1ccccc1)N(Cc1nc3c((nH)1)cccc3)c1c(N2)cccc1
ZINC000009281384
ZINC000009281385

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Available files

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