Vitas-M small molecule compound
5-amino-3-{(Z)-2-[5-(3-chloro-4-methylphenyl)furan-2-yl]-1-cyanoethenyl}-1-(2-hydroxyethyl)-1H-pyrazole-4-carbonitrile
Catalog ID
STK757553
SMILES OCCn1nc(c(c1N)C#N)/C(=C/c1ccc(o1)c1ccc(c(c1)Cl)C)/C#N
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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 C20H16ClN5O2 MW 393.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16ClN5O2/c1-12-2-3-13(9-17(12)21)18-5-4-15(28-18)8-14(10-22)19-16(11-23)20(24)26(25-19)6-7-27/h2-5,8-9,27H,6-7,24H2,1H3/b14-8+InChIKey
DIDSSXCQLDCECA-RIYZIHGNSA-NSynonyms
5amino3((Z)2(5(3chloro4methylphenyl)furan2yl)1cyanoethenyl)1(2hydroxyethyl)1Hpyrazole4carbonitrile
5AMINO3((Z)2(5(3CHLORO4METHYLPHENYL)FURAN2YL)1CYANOETHENYL)1(2HYDROXYETHYL)PYRAZOLE4CARBONITRILE
CC1=C(C=C(C=C1)C2=CC=C(O2)C=C(C#N)C3=NN(C(=C3C#N)N)CCO)Cl
InChI=1SC20H16ClN5O2c1122313(917(12)21)185415(2818)814(1022)1916(1123)20(24)26(2519)6727h258927H6724H21H3b148+
MFCD01160899
OCCn1nc(c(c1N)C#N)C(=Cc1ccc(o1)c1ccc(c(c1)Cl)C)C#N
ZINC000004482172
ZINC04482172
ZINC4482172
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