Vitas-M small molecule compound
2-{[(4-chloro-5-methyl-3-nitro-1H-pyrazol-1-yl)acetyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL329692
SMILES CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)Cn1nc(c(c1C)Cl)[N+](=O)[O-]
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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 C16H18ClN5O4S MW 411.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18ClN5O4S/c1-7-3-4-9-10(5-7)27-16(12(9)14(18)24)19-11(23)6-21-8(2)13(17)15(20-21)22(25)26/h7H,3-6H2,1-2H3,(H2,18,24)(H,19,23)InChIKey
NVMLWVRPOKXNPC-UHFFFAOYSA-NSynonyms
355804-98-72(((4chloro5methyl3nitro1Hpyrazol1yl)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxamide
2((2(4chloro5methyl3nitropyrazol1yl)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxamide
2(2(4chloro5methyl3nitro1Hpyrazol1yl)acetamido)6methyl4567tetrahydrobenzo(b)thiophene3carboxamide
355804987
CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CN3C(=C(C(=N3)(N+)(=O)(O))Cl)C
CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)Cn1nc(c(c1C)Cl)(N+)(=O)(O)
InChI=1SC16H18ClN5O4Sc1734910(57)2716(12(9)14(18)24)1911(23)6218(2)13(17)15(2021)22(25)26h7H36H212H3(H21824)(H1923)
MFCD01451933
ZINC000002084498
ZINC000002084499
Check stock
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