Vitas-M small molecule compound
N-benzyl-2-({[5-(1-methyl-1H-pyrazol-3-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)hydrazinecarbothioamide
Catalog ID
STL396026
SMILES O=C(CSc1nnc(n1CC1CCCO1)c1ccn(n1)C)NNC(=S)NCc1ccccc1
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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 C21H26N8O2S2 MW 486.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N8O2S2/c1-28-10-9-17(27-28)19-24-26-21(29(19)13-16-8-5-11-31-16)33-14-18(30)23-25-20(32)22-12-15-6-3-2-4-7-15/h2-4,6-7,9-10,16H,5,8,11-14H2,1H3,(H,23,30)(H2,22,25,32)InChIKey
WPRCCKPEXWZWKV-UHFFFAOYSA-NSynonyms
1005696-62-71005696627
1benzyl3((2((5(1methylpyrazol3yl)4(oxolan2ylmethyl)124triazol3yl)sulfanyl)acetyl)amino)thiourea
CN1C=CC(=N1)C2=NN=C(N2CC3CCCO3)SCC(=O)NNC(=S)NCC4=CC=CC=C4
InChI=1SC21H26N8O2S2c12810917(2728)19242621(29(19)131685113116)331418(30)232520(32)2212156324715h246791016H581114H21H3(H2330)(H2222532)
MFCD04131120
NBENZYL2(((5(1METHYL1HPYRAZOL3YL)4(TETRAHYDROFURAN2YLMETHYL)4H124TRIAZOL3YL)SULFANYL)ACETYL)HYDRAZINECARBOTHIOAMIDE
ZINC000020613859
ZINC000020613860
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