Vitas-M small molecule compound
4-chloro-N-[(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)carbamothioyl]-1-ethyl-1H-pyrazole-5-carboxamide
Catalog ID
STK961474
SMILES N#Cc1c(NC(=S)NC(=O)c2c(Cl)cnn2CC)sc2c1CCCCC2
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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 C17H18ClN5OS2 MW 407.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN5OS2/c1-2-23-14(12(18)9-20-23)15(24)21-17(25)22-16-11(8-19)10-6-4-3-5-7-13(10)26-16/h9H,2-7H2,1H3,(H2,21,22,24,25)InChIKey
MNPWFPPGYQOSFW-UHFFFAOYSA-NSynonyms
494217-80-0494217800
4chloroN((3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)carbamothioyl)1ethyl1Hpyrazole5carboxamide
4chloroN((3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)carbamothioyl)2ethylpyrazole3carboxamide
CCN1C(=C(C=N1)Cl)C(=O)NC(=S)NC2=C(C3=C(S2)CCCCC3)C#N
InChI=1SC17H18ClN5OS2c122314(12(18)92023)15(24)2117(25)221611(819)106435713(10)2616h9H27H21H3(H221222425)
MFCD02374255
ZINC000002776258
ZINC02776258
ZINC2776258
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