Vitas-M small molecule compound
N-(2,5-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
STL399413
SMILES O=C(CSc1nnc(n1CC1CCCO1)c1ccn(n1)C)NNC(=S)Nc1cc(C)ccc1C
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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/c1-14-6-7-15(2)18(11-14)23-21(33)26-24-19(31)13-34-22-27-25-20(17-8-9-29(3)28-17)30(22)12-16-5-4-10-32-16/h6-9,11,16H,4-5,10,12-13H2,1-3H3,(H,24,31)(H2,23,26,33)InChIKey
DXEHZIMBYGWWAQ-UHFFFAOYSA-NSynonyms
1005596-82-61(25dimethylphenyl)3((2((5(1methylpyrazol3yl)4(oxolan2ylmethyl)124triazol3yl)sulfanyl)acetyl)amino)thiourea
1005596826
CC1=CC(=C(C=C1)C)NC(=S)NNC(=O)CSC2=NN=C(N2CC3CCCO3)C4=NN(C=C4)C
InChI=1SC22H28N8O2S2c1146715(2)18(1114)2321(33)262419(31)133422272520(178929(3)2817)30(22)121654103216h691116H45101213H213H3(H2431)(H2232633)
MFCD04131373
N(25DIMETHYLPHENYL)2(((5(1METHYL1HPYRAZOL3YL)4(TETRAHYDROFURAN2YLMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINECARBOTHIOAMIDE
ZINC000022823281
ZINC000022823289
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