Vitas-M small molecule compound
(2E)-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1-(4-iodophenyl)prop-2-en-1-one
Catalog ID
STK956501
SMILES CCn1nc(c(c1C)/C=C/C(=O)c1ccc(cc1)I)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 C16H17IN2O MW 380.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17IN2O/c1-4-19-12(3)15(11(2)18-19)9-10-16(20)13-5-7-14(17)8-6-13/h5-10H,4H2,1-3H3/b10-9+InChIKey
VIXNNFLPGMNGBR-MDZDMXLPSA-NSynonyms
494791-24-1(2E)3(1ethyl35dimethyl1Hpyrazol4yl)1(4iodophenyl)prop2en1one
(E)3(1ETHYL35DIMETHYLPYRAZOL4YL)1(4IODOPHENYL)PROP2EN1ONE
3(1ETHYL35DIMETHYL1HPYRAZOL4YL)1(4IODOPHENYL)2PROPEN1ONE
494791241
CCN1C(=C(C(=N1)C)C=CC(=O)C2=CC=C(C=C2)I)C
CCn1nc(c(c1C)C=CC(=O)c1ccc(cc1)I)C
InChI=1SC16H17IN2Oc141912(3)15(11(2)1819)91016(20)135714(17)8613h510H4H213H3b109+
MFCD03075391
ZINC000004652012
ZINC04652012
ZINC4652012
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