Vitas-M small molecule compound
N-(2,3-dimethylphenyl)-2-({[5-(1-methyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinecarbothioamide
Catalog ID
STK307996
SMILES O=C(CSc1nnc(n1CC1CCCO1)c1ccn(n1)C)NNC(=S)Nc1cccc(c1C)C
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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 C22H28N8O2S2 MW 500.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N8O2S2/c1-14-6-4-8-17(15(14)2)23-21(33)26-24-19(31)13-34-22-27-25-20(18-9-10-29(3)28-18)30(22)12-16-7-5-11-32-16/h4,6,8-10,16H,5,7,11-13H2,1-3H3,(H,24,31)(H2,23,26,33)InChIKey
TXTINQKGDMPTSQ-UHFFFAOYSA-NSynonyms
1005640-91-41(23dimethylphenyl)3((2((5(1methylpyrazol3yl)4(oxolan2ylmethyl)124triazol3yl)sulfanyl)acetyl)amino)thiourea
1005640914
CC1=C(C(=CC=C1)NC(=S)NNC(=O)CSC2=NN=C(N2CC3CCCO3)C4=NN(C=C4)C)C
InChI=1SC22H28N8O2S2c11464817(15(14)2)2321(33)262419(31)133422272520(1891029(3)2818)30(22)121675113216h4681016H571113H213H3(H2431)(H2232633)
MFCD04054056
N(23dimethylphenyl)2(((5(1methyl1Hpyrazol3yl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)acetyl)hydrazinecarbothioamide
ZINC000013959912
ZINC000013959913
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