Vitas-M small molecule compound

(2E)-N-(7,7-dimethyl-5-oxo-5,6,7,8-tetrahydroquinazolin-2-yl)-3-(2-methylphenyl)prop-2-enamide

Catalog ID
STK320923
SMILES O=C(Nc1ncc2c(n1)CC(CC2=O)(C)C)/C=C/c1ccccc1C

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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 C20H21N3O2 MW 335.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O2/c1-13-6-4-5-7-14(13)8-9-18(25)23-19-21-12-15-16(22-19)10-20(2,3)11-17(15)24/h4-9,12H,10-11H2,1-3H3,(H,21,22,23,25)/b9-8+
InChIKey
RDDONGPXKZZNSI-CMDGGOBGSA-N
Synonyms
845899-52-7
(2E)N(77DIMETHYL5OXO(678TRIHYDROQUINAZOLIN2YL))3(2METHYLPHENYL)PROP2ENAMIDE
(2E)N(77dimethyl5oxo5678tetrahydroquinazolin2yl)3(2methylphenyl)prop2enamide
(E)N(77dimethyl5oxo5678tetrahydroquinazolin2yl)3(otolyl)acrylamide
(E)N(77DIMETHYL5OXO68DIHYDROQUINAZOLIN2YL)3(2METHYLPHENYL)PROP2ENAMIDE
845899527
CC1=CC=CC=C1C=CC(=O)NC2=NC=C3C(=N2)CC(CC3=O)(C)C
InChI=1SC20H21N3O2c113645714(13)8918(25)231921121516(2219)1020(23)1117(15)24h4912H1011H213H3(H21222325)b98+
MFCD04172700
O=C(Nc1ncc2c(n1)CC(CC2=O)(C)C)C=Cc1ccccc1C
ZINC000000539637
ZINC00539637
ZINC539637

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Available files

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