Vitas-M small molecule compound
6-amino-4-[4-(1H-benzimidazol-1-ylmethyl)thiophen-2-yl]-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK781148
SMILES N#CC1=C(N)Oc2c(C1c1scc(c1)Cn1cnc3c1cccc3)c(C)[nH]n2
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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 C20H16N6OS MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N6OS/c1-11-17-18(13(7-21)19(22)27-20(17)25-24-11)16-6-12(9-28-16)8-26-10-23-14-4-2-3-5-15(14)26/h2-6,9-10,18H,8,22H2,1H3,(H,24,25)InChIKey
KRFXBQHKBLCLGR-UHFFFAOYSA-NSynonyms
6amino4(4(1Hbenzimidazol1ylmethyl)thiophen2yl)3methyl24dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4(4(BENZIMIDAZOL1YLMETHYL)THIOPHEN2YL)3METHYL24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC1=C2C(C(=C(OC2=NN1)N)C#N)C3=CC(=CS3)CN4C=NC5=CC=CC=C54
InChI=1SC20H16N6OSc1111718(13(721)19(22)2720(17)252411)16612(92816)826102314423515(14)26h2691018H822H21H3(H2425)
MFCD06014380
N#CC1=C(N)Oc2c(C1c1scc(c1)Cn1cnc3c1cccc3)c(C)(nH)n2
ZINC000001432810
ZINC000001432811
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