Vitas-M small molecule compound
5-(4-chlorophenyl)-N-[1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-methyl-1H-pyrazol-5-yl]-1H-pyrazole-3-carboxamide
Catalog ID
STL318391
SMILES Clc1ccc(cc1)c1[nH]nc(c1)C(=O)Nc1cc(nn1C1CCS(=O)(=O)C1)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 C18H18ClN5O3S MW 419.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18ClN5O3S/c1-11-8-17(24(23-11)14-6-7-28(26,27)10-14)20-18(25)16-9-15(21-22-16)12-2-4-13(19)5-3-12/h2-5,8-9,14H,6-7,10H2,1H3,(H,20,25)(H,21,22)InChIKey
OOLBBIVSEBAKLU-UHFFFAOYSA-NSynonyms
3(4chlorophenyl)N(1(11dioxidotetrahydrothiophen3yl)3methyl1Hpyrazol5yl)1Hpyrazole5carboxamide
3(4chlorophenyl)N(2(11dioxothiolan3yl)5methylpyrazol3yl)1Hpyrazole5carboxamide
5(4chlorophenyl)N(1(11dioxidotetrahydrothiophen3yl)3methyl1Hpyrazol5yl)1Hpyrazole3carboxamide
CC1=NN(C(=C1)NC(=O)C2=CC(=NN2)C3=CC=C(C=C3)Cl)C4CCS(=O)(=O)C4
Clc1ccc(cc1)c1(nH)nc(c1)C(=O)Nc1cc(nn1C1CCS(=O)(=O)C1)C
Clc1ccc(cc1)c1n(nH)c(c1)C(=O)Nc1cc(nn1C1CCS(=O)(=O)C1)C
InChI=1SC18H18ClN5O3Sc111817(24(2311)146728(2627)1014)2018(25)16915(212216)122413(19)5312h258914H6710H21H3(H2025)(H2122)
MFCD28031259
ZINC000095479259
ZINC000095479260
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