Vitas-M small molecule compound
N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-nitro-1H-pyrazole-3-carboxamide
Catalog ID
STK306446
SMILES N#Cc1c(NC(=O)c2n[nH]cc2[N+](=O)[O-])sc2c1CCC(C2)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 C14H13N5O3S MW 331.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13N5O3S/c1-7-2-3-8-9(5-15)14(23-11(8)4-7)17-13(20)12-10(19(21)22)6-16-18-12/h6-7H,2-4H2,1H3,(H,16,18)(H,17,20)InChIKey
OFNGSLSVXIDDBJ-UHFFFAOYSA-NSynonyms
1005615-19-91005615199
CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C(C=NN3)(N+)(=O)(O)
InChI=1SC14H13N5O3Sc172389(515)14(2311(8)47)1713(20)1210(19(21)22)6161812h67H24H21H3(H1618)(H1720)
MFCD04129896
N#Cc1c(NC(=O)c2n(nH)cc2(N+)(=O)(O))sc2c1CCC(C2)C
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)4nitro1Hpyrazole3carboxamide
N(3cyano6methyl4567tetrahydro1benzothiophen2yl)4nitro1Hpyrazole5carboxamide
ZINC000006411898
ZINC000006411982
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