Vitas-M small molecule compound
5-[2-(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)ethyl]-4-(3-methylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK302438
SMILES Cc1cccc(c1)n1c(nnc1S)CCn1nc(c(c1C)[N+](=O)[O-])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 C16H18N6O2S MW 358.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6O2S/c1-10-5-4-6-13(9-10)21-14(17-18-16(21)25)7-8-20-12(3)15(22(23)24)11(2)19-20/h4-6,9H,7-8H2,1-3H3,(H,18,25)InChIKey
VRRDUIBPADYHAW-UHFFFAOYSA-NSynonyms
512824-65-63(2(35DIMETHYL4NITRO1PYRAZOLYL)ETHYL)4(3METHYLPHENYL)1H124TRIAZOLE5THIONE
3(2(35DIMETHYL4NITROPYRAZOL1YL)ETHYL)4(3METHYLPHENYL)1H124TRIAZOLE5THIONE
3(2(35DIMETHYL4NITROPYRAZOL1YL)ETHYL)4(MTOLYL)1H124TRIAZOLE5THIONE
3(2(4NITRO35DIMETHYL1HPYRAZOL1YL)ETHYL)4(3METHYLPHENYL)5SULFANYL4H124TRIAZOLE
5(2(35dimethyl4nitro1Hpyrazol1yl)ethyl)4(3methylphenyl)4H124triazole3thiol
512824656
CC1=CC(=CC=C1)N2C(=NNC2=S)CCN3C(=C(C(=N3)C)(N+)(=O)(O))C
Cc1cccc(c1)n1c(nnc1S)CCn1nc(c(c1C)(N+)(=O)(O))C
InChI=1SC16H18N6O2Sc11054613(910)2114(171816(21)25)782012(3)15(22(23)24)11(2)1920h469H78H213H3(H1825)
MFCD03468562
ZINC000005427265
ZINC05427265
ZINC5427265
Check stock
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Check stock on Vitas-MAvailable files
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