Vitas-M small molecule compound
N-(3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-1-[(2-fluorophenoxy)methyl]-1H-pyrazole-3-carboxamide
Catalog ID
STL401407
SMILES CC1CCc2c(C1)sc(c2C(=O)N)NC(=O)c1ccn(n1)COc1ccccc1F
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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 C21H21FN4O3S MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN4O3S/c1-12-6-7-13-17(10-12)30-21(18(13)19(23)27)24-20(28)15-8-9-26(25-15)11-29-16-5-3-2-4-14(16)22/h2-5,8-9,12H,6-7,10-11H2,1H3,(H2,23,27)(H,24,28)InChIKey
JYGXFUCAFDMREA-UHFFFAOYSA-NSynonyms
1005605-47-91005605479
CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=NN(C=C3)COC4=CC=CC=C4F
InChI=1SC21H21FN4O3Sc112671317(1012)3021(18(13)19(23)27)2420(28)158926(2515)112916532414(16)22h258912H671011H21H3(H22327)(H2428)
MFCD04132605
N(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)1((2fluorophenoxy)methyl)1Hpyrazole3carboxamide
N(3carbamoyl6methyl4567tetrahydro1benzothiophen2yl)1((2fluorophenoxy)methyl)pyrazole3carboxamide
ZINC000002798066
ZINC000002798067
ZINC02798066
ZINC02798067
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