Vitas-M small molecule compound

ethyl 1-{2-[(4-methyl-3-phenyl-3H-1,5-benzodiazepin-2-yl)amino]-2-oxoethyl}piperidine-3-carboxylate

Catalog ID
STK166955
SMILES CCOC(=O)C1CCCN(C1)CC(=O)NC1=Nc2ccccc2N=C(C1c1ccccc1)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 C26H30N4O3 MW 446.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O3/c1-3-33-26(32)20-12-9-15-30(16-20)17-23(31)29-25-24(19-10-5-4-6-11-19)18(2)27-21-13-7-8-14-22(21)28-25/h4-8,10-11,13-14,20,24H,3,9,12,15-17H2,1-2H3,(H,28,29,31)
InChIKey
LRMBMBPGFKLKDE-UHFFFAOYSA-N
Synonyms
700849-32-7
700849327
CCOC(=O)C1CCCN(C1)CC(=O)NC2=NC3=CC=CC=C3N=C(C2C4=CC=CC=C4)C
ETHYL1((N(4METHYL3PHENYL3HBENZO(B)14DIAZEPIN2YL)CARBAMOYL)METHYL)PIPERIDINE3CARBOXYLATE
ETHYL1(2((2METHYL3PHENYL3H15BENZODIAZEPIN4YL)AMINO)2OXOETHYL)PIPERIDINE3CARBOXYLATE
ETHYL1(2((4METHYL3PHENYL3H15BENZODIAZEPIN2YL)AMINO)2OXOETHYL)3PIPERIDINECARBOXYLATE
ETHYL1(2((4METHYL3PHENYL3H15BENZODIAZEPIN2YL)AMINO)2OXOETHYL)PIPERIDINE3CARBOXYLATE
ethyl1(2((4methyl3phenyl3Hbenzo(b)(14)diazepin2yl)amino)2oxoethyl)piperidine3carboxylate
InChI=1SC26H30N4O3c133326(32)201291530(1620)1723(31)292524(19105461119)18(2)272113781422(21)2825h48101113142024H39121517H212H3(H282931)
MFCD03903858
ZINC000008017912
ZINC000239339096

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Available files

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