Vitas-M small molecule compound
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
Catalog ID
STL170791
SMILES N#Cc1c(NC(=O)Cn2cnc(n2)[N+](=O)[O-])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 C14H14N6O3S MW 346.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N6O3S/c15-6-10-9-4-2-1-3-5-11(9)24-13(10)17-12(21)7-19-8-16-14(18-19)20(22)23/h8H,1-5,7H2,(H,17,21)InChIKey
PGBPRWNVLAIXLF-UHFFFAOYSA-NSynonyms
333762-96-2333762962
C1CCC2=C(CC1)SC(=C2C#N)NC(=O)CN3C=NC(=N3)(N+)(=O)(O)
InChI=1SC14H14N6O3Sc1561094213511(9)2413(10)1712(21)71981614(1819)20(22)23h8H157H2(H1721)
MFCD01449442
N#Cc1c(NC(=O)Cn2cnc(n2)(N+)(=O)(O))sc2c1CCCCC2
N(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)2(3nitro124triazol1yl)acetamide
N(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)2(3nitro1H124triazol1yl)acetamide
ZINC000002083615
ZINC02083615
ZINC2083615
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