Vitas-M small molecule compound
(2E)-1-(1,3-benzodioxol-5-yl)-3-{[4-(propan-2-yl)phenyl]amino}prop-2-en-1-one
Catalog ID
STK902220
SMILES O=C(c1ccc2c(c1)OCO2)/C=C/Nc1ccc(cc1)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 C19H19NO3 MW 309.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19NO3/c1-13(2)14-3-6-16(7-4-14)20-10-9-17(21)15-5-8-18-19(11-15)23-12-22-18/h3-11,13,20H,12H2,1-2H3/b10-9+InChIKey
BYOMTCZGHXFBFV-MDZDMXLPSA-NSynonyms
(2E)1(13benzodioxol5yl)3((4(propan2yl)phenyl)amino)prop2en1one
(E)1(13benzodioxol5yl)3(4propan2ylanilino)prop2en1one
CC(C)C1=CC=C(C=C1)NC=CC(=O)C2=CC3=C(C=C2)OCO3
InChI=1SC19H19NO3c113(2)143616(7414)2010917(21)15581819(1115)23122218h3111320H12H212H3b109+
MFCD18174746
O=C(c1ccc2c(c1)OCO2)C=CNc1ccc(cc1)C(C)C
ZINC000044842378
ZINC44842378
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