Vitas-M small molecule compound
11-(4-butoxyphenyl)-3,3-dimethyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
Catalog ID
STK132131
SMILES CCCCOc1ccc(cc1)C1Nc2ccccc2NC2=C1C(=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 C25H30N2O2 MW 390.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N2O2/c1-4-5-14-29-18-12-10-17(11-13-18)24-23-21(15-25(2,3)16-22(23)28)26-19-8-6-7-9-20(19)27-24/h6-13,24,26-27H,4-5,14-16H2,1-3H3InChIKey
QXGRKERNDASTRM-UHFFFAOYSA-NSynonyms
337503-01-211(4butoxyphenyl)33dimethyl23451011hexahydro1Hdibenzo(be)(14)diazepin1one
337503012
6(4butoxyphenyl)99dimethyl681011tetrahydro5Hbenzo(b)(14)benzodiazepin7one
CCCCOC1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC4=CC=CC=C4N2
InChI=1SC25H30N2O2c145142918121017(111318)242321(1525(23)1622(23)28)2619867920(19)2724h613242627H451416H213H3
MFCD01647921
ZINC000004459791
ZINC000004459797
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