Vitas-M small molecule compound
(4Z)-2-(4-methoxyphenyl)-5-methyl-4-(1-{[4-(1H-1,2,4-triazol-1-ylmethyl)phenyl]amino}ethylidene)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK232015
SMILES COc1ccc(cc1)N1N=C(/C(=C(/Nc2ccc(cc2)Cn2cncn2)\C)/C1=O)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 C22H22N6O2 MW 402.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N6O2/c1-15(25-18-6-4-17(5-7-18)12-27-14-23-13-24-27)21-16(2)26-28(22(21)29)19-8-10-20(30-3)11-9-19/h4-11,13-14,25H,12H2,1-3H3/b21-15-InChIKey
MAOJGVYLOVYIJI-QNGOZBTKSA-NSynonyms
(4Z)2(4methoxyphenyl)5methyl4(1((4(1H124triazol1ylmethyl)phenyl)amino)ethylidene)24dihydro3Hpyrazol3one
(4Z)2(4METHOXYPHENYL)5METHYL4(1(4(124TRIAZOL1YLMETHYL)ANILINO)ETHYLIDENE)PYRAZOL3ONE
1(4METHOXYPHENYL)3METHYL4(((4(124TRIAZOLYLMETHYL)PHENYL)AMINO)ETHYLIDENE)12DIAZOLIN5ONE
CC1=NN(C(=O)C1=C(C)NC2=CC=C(C=C2)CN3C=NC=N3)C4=CC=C(C=C4)OC
COc1ccc(cc1)N1N=C(C(=C(Nc2ccc(cc2)Cn2cncn2)C)C1=O)C
InChI=1SC22H22N6O2c115(25186417(5718)12271423132427)2116(2)2628(22(21)29)1981020(303)11919h411131425H12H213H3b2115
MFCD08086046
ZINC000100422617
ZINC100422617
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