Vitas-M small molecule compound

ethyl 2-{[(5-chloro-2-nitrophenyl)carbonyl]amino}-5-propylthiophene-3-carboxylate

Catalog ID
STK451339
SMILES CCOC(=O)c1cc(sc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-])CCC

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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 C17H17ClN2O5S MW 396.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN2O5S/c1-3-5-11-9-13(17(22)25-4-2)16(26-11)19-15(21)12-8-10(18)6-7-14(12)20(23)24/h6-9H,3-5H2,1-2H3,(H,19,21)
InChIKey
CDQXOLRKDVHDOL-UHFFFAOYSA-N
Synonyms

CCCC1=CC(=C(S1)NC(=O)C2=C(C=CC(=C2)Cl)(N+)(=O)(O))C(=O)OCC
CCOC(=O)c1cc(sc1NC(=O)c1cc(Cl)ccc1(N+)(=O)(O))CCC
ethyl2(((5chloro2nitrophenyl)carbonyl)amino)5propylthiophene3carboxylate
ETHYL2((5CHLORO2NITROBENZOYL)AMINO)5PROPYL3THIOPHENECARBOXYLATE
ETHYL2((5CHLORO2NITROBENZOYL)AMINO)5PROPYLTHIOPHENE3CARBOXYLATE
ETHYL2((5CHLORO2NITROPHENYL)CARBONYLAMINO)5PROPYLTHIOPHENE3CARBOXYLATE
InChI=1SC17H17ClN2O5Sc13511913(17(22)2542)16(2611)1915(21)12810(18)6714(12)20(23)24h69H35H212H3(H1921)
MFCD02608138
ZINC000000668997
ZINC00668997
ZINC668997

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Available files

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