Vitas-M small molecule compound
11-[2-(butan-2-yloxy)phenyl]-10-hexanoyl-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STL171797
SMILES CCCCCC(=O)N1c2ccccc2NC2=C(C1c1ccccc1OC(CC)C)C(=O)CC(C2)(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/c1-6-8-9-18-28(35)33-25-16-12-11-15-23(25)32-24-19-31(4,5)20-26(34)29(24)30(33)22-14-10-13-17-27(22)36-21(3)7-2/h10-17,21,30,32H,6-9,18-20H2,1-5H3InChIKey
MDYYBDCIRXDYDJ-UHFFFAOYSA-NSynonyms
438467-02-811(2(butan2yloxy)phenyl)10hexanoyl33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
438467028
6(2butan2yloxyphenyl)5hexanoyl99dimethyl681011tetrahydrobenzo(b)(14)benzodiazepin7one
CCCCCC(=O)N1C(C2=C(CC(CC2=O)(C)C)NC3=CC=CC=C31)C4=CC=CC=C4OC(C)CC
InChI=1SC31H40N2O3c16891828(35)33251612111523(25)32241931(45)2026(34)29(24)30(33)221410131727(22)3621(3)72h1017213032H691820H215H3
MFCD01922069
ZINC000008444394
ZINC000008444397
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