Vitas-M small molecule compound
4-chloro-N-[(2,4-dimethyl-6-nitrophenyl)carbamothioyl]-1,3-dimethyl-1H-pyrazole-5-carboxamide
Catalog ID
STK961450
SMILES S=C(Nc1c(C)cc(cc1[N+](=O)[O-])C)NC(=O)c1n(C)nc(c1Cl)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 C15H16ClN5O3S MW 381.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H16ClN5O3S/c1-7-5-8(2)12(10(6-7)21(23)24)17-15(25)18-14(22)13-11(16)9(3)19-20(13)4/h5-6H,1-4H3,(H2,17,18,22,25)InChIKey
WAIPNFSAGUOWGE-UHFFFAOYSA-NSynonyms
494746-38-2494746382
4chloroN((24dimethyl6nitrophenyl)carbamothioyl)13dimethyl1Hpyrazole5carboxamide
4CHLORON((24DIMETHYL6NITROPHENYL)CARBAMOTHIOYL)25DIMETHYLPYRAZOLE3CARBOXAMIDE
CC1=CC(=C(C(=C1)(N+)(=O)(O))NC(=S)NC(=O)C2=C(C(=NN2C)C)Cl)C
InChI=1SC15H16ClN5O3Sc1758(2)12(10(67)21(23)24)1715(25)1814(22)1311(16)9(3)1920(13)4h56H14H3(H217182225)
MFCD02374097
N((4CHLORO13DIMETHYL1HPYRAZOL5YL)CARBONYL)N(2NITRO46DIMETHYLPHENYL)THIOUREA
S=C(Nc1c(C)cc(cc1(N+)(=O)(O))C)NC(=O)c1n(C)nc(c1Cl)C
ZINC000005587392
ZINC05587392
ZINC5587392
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