Vitas-M small molecule compound

ethyl 7-(furan-2-yl)-2-methyl-4-[4-(methylsulfanyl)phenyl]-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK406493
SMILES CCOC(=O)C1=C(C)NC2=C(C1c1ccc(cc1)SC)C(=O)CC(C2)c1ccco1

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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 C24H25NO4S MW 423.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25NO4S/c1-4-28-24(27)21-14(2)25-18-12-16(20-6-5-11-29-20)13-19(26)23(18)22(21)15-7-9-17(30-3)10-8-15/h5-11,16,22,25H,4,12-13H2,1-3H3
InChIKey
JEWWBTAFYIWENM-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(NC2=C(C1C3=CC=C(C=C3)SC)C(=O)CC(C2)C4=CC=CO4)C
ethyl7(furan2yl)2methyl4(4(methylsulfanyl)phenyl)5oxo145678hexahydroquinoline3carboxylate
ethyl7(furan2yl)2methyl4(4methylsulfanylphenyl)5oxo4678tetrahydro1Hquinoline3carboxylate
InChI=1SC24H25NO4Sc142824(27)2114(2)25181216(2065112920)1319(26)23(18)22(21)157917(303)10815h511162225H41213H213H3
MFCD05986616
ZINC000020059642
ZINC000020059651

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Available files

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