Vitas-M small molecule compound
ethyl 2-[(cyclopropylcarbonyl)amino]-5-{[2-(ethoxycarbonyl)phenyl]carbamoyl}-4-methylthiophene-3-carboxylate
Catalog ID
STK090513
SMILES CCOC(=O)c1ccccc1NC(=O)c1sc(c(c1C)C(=O)OCC)NC(=O)C1CC1
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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 C22H24N2O6S MW 444.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O6S/c1-4-29-21(27)14-8-6-7-9-15(14)23-19(26)17-12(3)16(22(28)30-5-2)20(31-17)24-18(25)13-10-11-13/h6-9,13H,4-5,10-11H2,1-3H3,(H,23,26)(H,24,25)InChIKey
PAJNROVRAIXIHG-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CC=CC=C1NC(=O)C2=C(C(=C(S2)NC(=O)C3CC3)C(=O)OCC)C
CCOC(=O)c1ccccc1NC(=O)c1sc(c(c1C)C(=O)OCC)NC(=O)C1CC1
ETHYL2((5(CYCLOPROPYLCARBONYLAMINO)4(ETHOXYCARBONYL)3METHYL2THIENYL)CARBONYLAMINO)BENZOATE
ETHYL2((CYCLOPROPYLCARBONYL)AMINO)5((2(ETHOXYCARBONYL)PHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL2(CYCLOPROPANECARBONYLAMINO)5((2ETHOXYCARBONYLPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
InChI=1SC22H24N2O6Sc142921(27)14867915(14)2319(26)1712(3)16(22(28)3052)20(3117)2418(25)13101113h6913H451011H213H3(H2326)(H2425)
MFCD01874826
STK090513
ZINC000001215049
ZINC01215049
ZINC1215049
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Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.