Vitas-M small molecule compound
propan-2-yl 2-chloro-5-({(Z)-[3-methyl-1-(naphthalen-1-yl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)benzoate
Catalog ID
STK957477
SMILES CC(OC(=O)c1cc(N/C=C\2/C(=NN(C2=O)c2cccc3c2cccc3)C)ccc1Cl)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 C25H22ClN3O3 MW 447.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22ClN3O3/c1-15(2)32-25(31)20-13-18(11-12-22(20)26)27-14-21-16(3)28-29(24(21)30)23-10-6-8-17-7-4-5-9-19(17)23/h4-15,27H,1-3H3/b21-14-InChIKey
PIHJZCAHTZZOIQ-STZFKDTASA-NSynonyms
352683-53-5352683535
CC(OC(=O)c1cc(NC=C2C(=NN(C2=O)c2cccc3c2cccc3)C)ccc1Cl)C
CC1=NN(C(=O)C1=CNC2=CC(=C(C=C2)Cl)C(=O)OC(C)C)C3=CC=CC4=CC=CC=C43
InChI=1SC25H22ClN3O3c115(2)3225(31)201318(111222(20)26)27142116(3)2829(24(21)30)23106817745919(17)23h41527H13H3b2114
ISOPROPYL2CHLORO5(((3METHYL1(1NAPHTHYL)5OXO15DIHYDRO4HPYRAZOL4YLIDENE)METHYL)AMINO)BENZOATE
MFCD01178631
propan2yl2chloro5(((Z)(3methyl1(naphthalen1yl)5oxo15dihydro4Hpyrazol4ylidene)methyl)amino)benzoate
PROPAN2YL2CHLORO5(((Z)(3METHYL1NAPHTHALEN1YL5OXOPYRAZOL4YLIDENE)METHYL)AMINO)BENZOATE
ZINC000008430450
ZINC08430450
ZINC8430450
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