Vitas-M small molecule compound
ethyl 1-methyl-5-{[3-(propoxycarbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}-1H-pyrazole-3-carboxylate
Catalog ID
STK956070
SMILES CCCOC(=O)c1c(NC(=O)c2cc(nn2C)C(=O)OCC)sc2c1CCCC2
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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 C20H25N3O5S MW 419.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O5S/c1-4-10-28-20(26)16-12-8-6-7-9-15(12)29-18(16)21-17(24)14-11-13(22-23(14)3)19(25)27-5-2/h11H,4-10H2,1-3H3,(H,21,24)InChIKey
BIDYUPGUGHOCMN-UHFFFAOYSA-NSynonyms
512808-89-8512808898
CCCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=CC(=NN3C)C(=O)OCC
ethyl1methyl5((3(propoxycarbonyl)4567tetrahydro1benzothiophen2yl)carbamoyl)1Hpyrazole3carboxylate
ethyl1methyl5((3propoxycarbonyl4567tetrahydro1benzothiophen2yl)carbamoyl)pyrazole3carboxylate
InChI=1SC20H25N3O5Sc14102820(26)1612867915(12)2918(16)2117(24)141113(2223(14)3)19(25)2752h11H410H213H3(H2124)
MFCD03074243
ZINC000002111281
ZINC02111281
ZINC2111281
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