Vitas-M small molecule compound
3-(4-tert-butylphenyl)-10-propanoyl-11-(thiophen-2-yl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK766516
SMILES CCC(=O)N1c2ccccc2NC2=C(C1c1cccs1)C(=O)CC(C2)c1ccc(cc1)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 C30H32N2O2S MW 484.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O2S/c1-5-27(34)32-24-10-7-6-9-22(24)31-23-17-20(19-12-14-21(15-13-19)30(2,3)4)18-25(33)28(23)29(32)26-11-8-16-35-26/h6-16,20,29,31H,5,17-18H2,1-4H3InChIKey
IKQRYZMCLVNHLZ-UHFFFAOYSA-NSynonyms
3(4tertbutylphenyl)10propanoyl11(thiophen2yl)23451011hexahydro1Hdibenzo(be)(14)diazepin1one
9(4tertbutylphenyl)5propanoyl6thiophen2yl891011tetrahydro6Hbenzo(b)(14)benzodiazepin7one
CCC(=O)N1C(C2=C(CC(CC2=O)C3=CC=C(C=C3)C(C)(C)C)NC4=CC=CC=C41)C5=CC=CS5
InChI=1SC30H32N2O2Sc1527(34)32241076922(24)31231720(19121421(151319)30(23)4)1825(33)28(23)29(32)26118163526h616202931H51718H214H3
MFCD03036108
ZINC000000718136
ZINC000000718139
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