Vitas-M small molecule compound

1-butyl-3-methyl-1,3,4,5-tetrahydro-2H-1,5-benzodiazepin-2-one

Catalog ID
STL450739
SMILES CCCCN1C(=O)C(C)CNc2c1cccc2

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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 C14H20N2O MW 232.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H20N2O/c1-3-4-9-16-13-8-6-5-7-12(13)15-10-11(2)14(16)17/h5-8,11,15H,3-4,9-10H2,1-2H3
InChIKey
RDWTYRUKLWCMGT-UHFFFAOYSA-N
Synonyms

1butyl3methyl1345tetrahydro2H15benzodiazepin2one
5butyl3methyl23dihydro1H15benzodiazepin4one
CCCCN1C2=CC=CC=C2NCC(C1=O)C
InChI=1SC14H20N2Oc13491613865712(13)151011(2)14(16)17h581115H34910H212H3
MFCD23699710
ZINC000082087113
ZINC000082087114

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.