Vitas-M small molecule compound

4-tert-butyl-N-[(3Z)-1-butyl-8-methyl-1,2-dihydro-3H-pyrazolo[3,4-b]quinolin-3-ylidene]benzamide

Catalog ID
STL054394
SMILES CCCCn1[nH]/c(=N\C(=O)c2ccc(cc2)C(C)(C)C)/c2c1nc1c(C)cccc1c2

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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 C26H30N4O MW 414.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N4O/c1-6-7-15-30-24-21(16-19-10-8-9-17(2)22(19)27-24)23(29-30)28-25(31)18-11-13-20(14-12-18)26(3,4)5/h8-14,16H,6-7,15H2,1-5H3,(H,28,29,31)
InChIKey
TUIFRKGNWQTMEM-UHFFFAOYSA-N
Synonyms
714291-77-7
4tertbutylN((3Z)1butyl8methyl12dihydro3Hpyrazolo(34b)quinolin3ylidene)benzamide
4TERTBUTYLN(1BUTYL8METHYLPYRAZOLO(34B)QUINOLIN3YL)BENZAMIDE
714291777
CCCCn1(nH)c(=NC(=O)c2ccc(cc2)C(C)(C)C)c2c1nc1c(C)cccc1c2
CCCCN1C2=C(C=C3C=CC=C(C3=N2)C)C(=N1)NC(=O)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC26H30N4Oc16715302421(1619108917(2)22(19)2724)23(2930)2825(31)18111320(141218)26(34)5h81416H6715H215H3(H282931)
MFCD05730471
ZINC000005499799
ZINC05499799
ZINC5499799

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Available files

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