Vitas-M small molecule compound
6-amino-3-(3-methoxyphenyl)-4-(4-nitrophenyl)-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STL052483
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)[N+](=O)[O-])c([nH]n2)c1cccc(c1)OC
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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 C20H15N5O4 MW 389.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N5O4/c1-28-14-4-2-3-12(9-14)18-17-16(11-5-7-13(8-6-11)25(26)27)15(10-21)19(22)29-20(17)24-23-18/h2-9,16H,22H2,1H3,(H,23,24)InChIKey
HCGSFXZTQIKFTB-UHFFFAOYSA-NSynonyms
846596-30-36amino3(3methoxyphenyl)4(4nitrophenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6amino3(3methoxyphenyl)4(4nitrophenyl)24dihydropyrano(23c)pyrazole5carbonitrile
846596303
COC1=CC=CC(=C1)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC20H15N5O4c1281442312(914)181716(115713(8611)25(26)27)15(1021)19(22)2920(17)242318h2916H22H21H3(H2324)
MFCD05732878
N#CC1=C(N)Oc2c(C1c1ccc(cc1)(N+)(=O)(O))c((nH)n2)c1cccc(c1)OC
N#CC1=C(N)Oc2c(C1c1ccc(cc1)(N+)(=O)(O))c(n(nH)2)c1cccc(c1)OC
ZINC000017248983
ZINC000017248985
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