Vitas-M small molecule compound
4-[5-(6-chloro[1,3]dioxolo[4,5-g]quinolin-7-yl)-3-(4-methylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoic acid
Catalog ID
STL239265
SMILES OC(=O)CCC(=O)N1N=C(CC1c1cc2cc3OCOc3cc2nc1Cl)c1ccc(cc1)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 C24H20ClN3O5 MW 465.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O5/c1-13-2-4-14(5-3-13)18-10-19(28(27-18)22(29)6-7-23(30)31)16-8-15-9-20-21(33-12-32-20)11-17(15)26-24(16)25/h2-5,8-9,11,19H,6-7,10,12H2,1H3,(H,30,31)InChIKey
LIXTVBDZZPQGMI-UHFFFAOYSA-NSynonyms
685135-57-34(3(6CHLORO(13)DIOXOLO(45G)QUINOLIN7YL)5(4METHYLPHENYL)34DIHYDROPYRAZOL2YL)4OXOBUTANOICACID
4(5(6chloro(13)dioxolo(45g)quinolin7yl)3(4methylphenyl)45dihydro1Hpyrazol1yl)4oxobutanoicacid
4(5(6CHLORO(13)DIOXOLO(45G)QUINOLIN7YL)3(PTOLYL)45DIHYDRO1HPYRAZOL1YL)4OXOBUTANOICACID
685135573
CC1=CC=C(C=C1)C2=NN(C(C2)C3=C(N=C4C=C5C(=CC4=C3)OCO5)Cl)C(=O)CCC(=O)O
InChI=1SC24H20ClN3O5c1132414(5313)181019(28(2718)22(29)6723(30)31)1681592021(33123220)1117(15)2624(16)25h25891119H671012H21H3(H3031)
MFCD03689756
ZINC000009638717
ZINC000009638723
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