Vitas-M small molecule compound

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

Catalog ID
STK453274
SMILES CCOC(=O)c1sc(c(c1C)C(=O)N)NC(=O)c1c(OCC)ccc2c1cccc2

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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 C22H22N2O5S MW 426.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N2O5S/c1-4-28-15-11-10-13-8-6-7-9-14(13)17(15)20(26)24-21-16(19(23)25)12(3)18(30-21)22(27)29-5-2/h6-11H,4-5H2,1-3H3,(H2,23,25)(H,24,26)
InChIKey
BSQJSGXZIVRUMM-UHFFFAOYSA-N
Synonyms

CCOC1=C(C2=CC=CC=C2C=C1)C(=O)NC3=C(C(=C(S3)C(=O)OCC)C)C(=O)N
ETHYL4(AMINOCARBONYL)5((2ETHOXY1NAPHTHOYL)AMINO)3METHYL2THIOPHENECARBOXYLATE
ethyl4carbamoyl5(((2ethoxynaphthalen1yl)carbonyl)amino)3methylthiophene2carboxylate
ETHYL4CARBAMOYL5((2ETHOXYNAPHTHALENE1CARBONYL)AMINO)3METHYLTHIOPHENE2CARBOXYLATE
ETHYL4CARBAMOYL5((2ETHOXYNAPHTHYL)CARBONYLAMINO)3METHYLTHIOPHENE2CARBOXYLATE
InChI=1SC22H22N2O5Sc142815111013867914(13)17(15)20(26)242116(19(23)25)12(3)18(3021)22(27)2952h611H45H213H3(H22325)(H2426)
MFCD02606225
ZINC000000667211
ZINC00667211
ZINC667211

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Available files

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