Vitas-M small molecule compound
6-amino-4-(cyclohex-2-en-1-yl)-3-{[(4-methylphenyl)sulfanyl]methyl}-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Catalog ID
STK546253
SMILES N#CC1=C(N)Oc2c(C1C1CCCC=C1)c(CSc1ccc(cc1)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 C21H22N4OS MW 378.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4OS/c1-13-7-9-15(10-8-13)27-12-17-19-18(14-5-3-2-4-6-14)16(11-22)20(23)26-21(19)25-24-17/h3,5,7-10,14,18H,2,4,6,12,23H2,1H3,(H,24,25)InChIKey
LHFVVKPCXNHLOM-UHFFFAOYSA-NSynonyms
445391-10-6445391106
6amino4(cyclohex2en1yl)3(((4methylphenyl)sulfanyl)methyl)24dihydropyrano(23c)pyrazole5carbonitrile
6amino4(cyclohex2en1yl)3((ptolylthio)methyl)24dihydropyrano(23c)pyrazole5carbonitrile
6AMINO4CYCLOHEX2EN1YL3((4METHYLPHENYL)SULFANYLMETHYL)24DIHYDROPYRANO(23C)PYRAZOLE5CARBONITRILE
CC1=CC=C(C=C1)SCC2=C3C(C(=C(OC3=NN2)N)C#N)C4CCCC=C4
InChI=1SC21H22N4OSc1137915(10813)2712171918(145324614)16(1122)20(23)2621(19)252417h357101418H2461223H21H3(H2425)
MFCD03234786
N#CC1=C(N)Oc2c(C1C1CCCC=C1)c(CSc1ccc(cc1)C)(nH)n2
ZINC000000663785
ZINC000000663791
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