Vitas-M small molecule compound
6-amino-4-[4-(methylsulfanyl)phenyl]-3-(3,4,5-trimethoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK996324
SMILES N#CC1=C(N)Oc2c(C1c1ccc(cc1)SC)c(n[nH]2)c1cc(OC)c(c(c1)OC)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 C23H22N4O4S MW 450.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O4S/c1-28-16-9-13(10-17(29-2)21(16)30-3)20-19-18(12-5-7-14(32-4)8-6-12)15(11-24)22(25)31-23(19)27-26-20/h5-10,18H,25H2,1-4H3,(H,26,27)InChIKey
ZFNGPBVMGYSGQF-UHFFFAOYSA-NSynonyms
6amino4(4(methylsulfanyl)phenyl)3(345trimethoxyphenyl)14dihydropyrano(23c)pyrazole5carbonitrile
6amino4(4methylsulfanylphenyl)3(345trimethoxyphenyl)24dihydropyrano(23c)pyrazole5carbonitrile
COC1=CC(=CC(=C1OC)OC)C2=C3C(C(=C(OC3=NN2)N)C#N)C4=CC=C(C=C4)SC
InChI=1SC23H22N4O4Sc12816913(1017(292)21(16)303)201918(125714(324)8612)15(1124)22(25)3123(19)272620h51018H25H214H3(H2627)
MFCD01971708
N#CC1=C(N)Oc2c(C1c1ccc(cc1)SC)c(n(nH)2)c1cc(OC)c(c(c1)OC)OC
ZINC000051331014
ZINC000051331015
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