Vitas-M small molecule compound

propan-2-yl 5-(diethylcarbamoyl)-2-{[(2-ethoxynaphthalen-1-yl)carbonyl]amino}-4-methylthiophene-3-carboxylate

Catalog ID
STK452757
SMILES CCOc1ccc2c(c1C(=O)Nc1sc(c(c1C(=O)OC(C)C)C)C(=O)N(CC)CC)cccc2

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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 C27H32N2O5S MW 496.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N2O5S/c1-7-29(8-2)26(31)23-17(6)21(27(32)34-16(4)5)25(35-23)28-24(30)22-19-13-11-10-12-18(19)14-15-20(22)33-9-3/h10-16H,7-9H2,1-6H3,(H,28,30)
InChIKey
WBUHUELZCQYCRB-UHFFFAOYSA-N
Synonyms

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=C(C=CC3=CC=CC=C32)OCC)C(=O)OC(C)C)C
InChI=1SC27H32N2O5Sc1729(82)26(31)2317(6)21(27(32)3416(4)5)25(3523)2824(30)22191311101218(19)141520(22)3393h1016H79H216H3(H2830)
ISOPROPYL5((DIETHYLAMINO)CARBONYL)2((2ETHOXY1NAPHTHOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
METHYLETHYL5(NNDIETHYLCARBAMOYL)2((2ETHOXYNAPHTHYL)CARBONYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD02606913
propan2yl5(diethylcarbamoyl)2(((2ethoxynaphthalen1yl)carbonyl)amino)4methylthiophene3carboxylate
PROPAN2YL5(DIETHYLCARBAMOYL)2((2ETHOXYNAPHTHALENE1CARBONYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ZINC000000673404
ZINC00673404
ZINC673404

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.