Vitas-M small molecule compound

methyl 2-{[2-(4-chlorophenoxy)-2-methylpropanoyl]amino}-4,5-dihydronaphtho[2,1-b]thiophene-1-carboxylate

Catalog ID
STK423312
SMILES COC(=O)c1c(NC(=O)C(Oc2ccc(cc2)Cl)(C)C)sc2c1c1ccccc1CC2

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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 C24H22ClNO4S MW 455.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClNO4S/c1-24(2,30-16-11-9-15(25)10-12-16)23(28)26-21-20(22(27)29-3)19-17-7-5-4-6-14(17)8-13-18(19)31-21/h4-7,9-12H,8,13H2,1-3H3,(H,26,28)
InChIKey
HVCZDEAWAOKYSP-UHFFFAOYSA-N
Synonyms

CC(C)(C(=O)NC1=C(C2=C(S1)CCC3=CC=CC=C32)C(=O)OC)OC4=CC=C(C=C4)Cl
InChI=1SC24H22ClNO4Sc124(2301611915(25)101216)23(28)262120(22(27)293)1917754614(17)81318(19)3121h47912H813H213H3(H2628)
METHYL2((2(4CHLOROPHENOXY)2METHYLPROPANOYL)AMINO)45DIHYDROBENZO(E)(1)BENZOTHIOLE1CARBOXYLATE
methyl2((2(4chlorophenoxy)2methylpropanoyl)amino)45dihydronaphtho(21b)thiophene1carboxylate
METHYL2(2(4CHLOROPHENOXY)2METHYLPROPANOYLAMINO)45DIHYDROBENZO(E)BENZO(B)THIOPHENECARBOXYLATE
MFCD02176181
ZINC000002088791
ZINC02088791
ZINC2088791

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Available files

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