Vitas-M small molecule compound

6-amino-4-[4-(benzyloxy)phenyl]-3-(4-ethoxy-3-methoxyphenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

Catalog ID
STL041487
SMILES CCOc1ccc(cc1OC)c1[nH]nc2c1C(c1ccc(cc1)OCc1ccccc1)C(=C(O2)N)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 C29H26N4O4 MW 494.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N4O4/c1-3-35-23-14-11-20(15-24(23)34-2)27-26-25(22(16-30)28(31)37-29(26)33-32-27)19-9-12-21(13-10-19)36-17-18-7-5-4-6-8-18/h4-15,25H,3,17,31H2,1-2H3,(H,32,33)
InChIKey
VOPIVPCTJSOIFT-UHFFFAOYSA-N
Synonyms
877622-16-7
6AMINO3(4ETHOXY3METHOXYPHENYL)4(4PHENYLMETHOXYPHENYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
6amino4(4(benzyloxy)phenyl)3(4ethoxy3methoxyphenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6amino4(4(benzyloxy)phenyl)3(4ethoxy3methoxyphenyl)24dihydropyrano(23c)pyrazole5carbonitrile
877622167
CCOC1=C(C=C(C=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(C=C4)OCC5=CC=CC=C5)OC
CCOc1ccc(cc1OC)c1(nH)nc2c1C(c1ccc(cc1)OCc1ccccc1)C(=C(O2)N)C#N
CCOc1ccc(cc1OC)c1n(nH)c2c1C(c1ccc(cc1)OCc1ccccc1)C(=C(O2)N)C#N
InChI=1SC29H26N4O4c133523141120(1524(23)342)272625(22(1630)28(31)3729(26)333227)1991221(131019)3617187546818h41525H31731H212H3(H3233)
MFCD05731115
ZINC000009292974
ZINC000009292975

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Available files

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