Vitas-M small molecule compound
11-(3-butoxyphenyl)-10-hexanoyl-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK139434
SMILES CCCCCC(=O)N1C(c2cccc(c2)OCCCC)C2=C(Nc3c1cccc3)CC(CC2=O)(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 C31H40N2O3 MW 488.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H40N2O3/c1-5-7-9-17-28(35)33-26-16-11-10-15-24(26)32-25-20-31(3,4)21-27(34)29(25)30(33)22-13-12-14-23(19-22)36-18-8-6-2/h10-16,19,30,32H,5-9,17-18,20-21H2,1-4H3InChIKey
WMDXJCIHSAHGSX-UHFFFAOYSA-NSynonyms
371145-07-211(3butoxyphenyl)10hexanoyl33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
371145072
6(3butoxyphenyl)5hexanoyl99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC(=CC=C4)OCCCC
InChI=1SC31H40N2O3c15791728(35)33261611101524(26)32252031(34)2127(34)29(25)30(33)2213121423(1922)3618862h1016193032H5917182021H214H3
MFCD01921848
ZINC000018250066
ZINC000018250068
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