Vitas-M small molecule compound
N-{3-[(2,5-dichlorophenyl)carbamoyl]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-1-methyl-1H-pyrazole-5-carboxamide
Catalog ID
STK444018
SMILES CC1CCc2c(C1)sc(c2C(=O)Nc1cc(Cl)ccc1Cl)NC(=O)c1ccnn1C
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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 C21H20Cl2N4O2S MW 463.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20Cl2N4O2S/c1-11-3-5-13-17(9-11)30-21(26-19(28)16-7-8-24-27(16)2)18(13)20(29)25-15-10-12(22)4-6-14(15)23/h4,6-8,10-11H,3,5,9H2,1-2H3,(H,25,29)(H,26,28)InChIKey
UAAZZKKIZURPLB-UHFFFAOYSA-NSynonyms
CC1CCC2=C(C1)SC(=C2C(=O)NC3=C(C=CC(=C3)Cl)Cl)NC(=O)C4=CC=NN4C
InChI=1SC21H20Cl2N4O2Sc111351317(911)3021(2619(28)16782427(16)2)18(13)20(29)25151012(22)4614(15)23h4681011H359H212H3(H2529)(H2628)
MFCD04055213
N(3((25dichlorophenyl)carbamoyl)6methyl4567tetrahydro1benzothiophen2yl)1methyl1Hpyrazole5carboxamide
N(3((25dichlorophenyl)carbamoyl)6methyl4567tetrahydro1benzothiophen2yl)2methylpyrazole3carboxamide
ZINC000020563023
ZINC000020563026
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