Vitas-M small molecule compound

propan-2-yl 2-{[(4-chlorophenyl)acetyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK429242
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)Cc1ccc(cc1)Cl)CC

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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 C22H27ClN2O4S MW 450.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27ClN2O4S/c1-6-25(7-2)21(27)19-14(5)18(22(28)29-13(3)4)20(30-19)24-17(26)12-15-8-10-16(23)11-9-15/h8-11,13H,6-7,12H2,1-5H3,(H,24,26)
InChIKey
KTKNCNLGNFHHHT-UHFFFAOYSA-N
Synonyms

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)CC2=CC=C(C=C2)Cl)C(=O)OC(C)C)C
InChI=1SC22H27ClN2O4Sc1625(72)21(27)1914(5)18(22(28)2913(3)4)20(3019)2417(26)121581016(23)11915h81113H6712H215H3(H2426)
METHYLETHYL5(NNDIETHYLCARBAMOYL)2(2(4CHLOROPHENYL)ACETYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD01338066
propan2yl2(((4chlorophenyl)acetyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
PROPAN2YL2((2(4CHLOROPHENYL)ACETYL)AMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ZINC000002734214
ZINC02734214
ZINC2734214

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Available files

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