Vitas-M small molecule compound
ethyl (5Z)-4-oxo-2-(phenylamino)-5-[4-(pyrrolidin-1-yl)benzylidene]-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STL378678
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2ccc(cc2)N2CCCC2)/C1=O
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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 C24H24N2O3S MW 420.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O3S/c1-2-29-24(28)21-22(27)20(30-23(21)25-18-8-4-3-5-9-18)16-17-10-12-19(13-11-17)26-14-6-7-15-26/h3-5,8-13,16,25H,2,6-7,14-15H2,1H3/b20-16-InChIKey
DWGZXWMWQSNIHW-SILNSSARSA-NSynonyms
CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2ccc(cc2)N2CCCC2)C1=O
CCOC(=O)C1=C(SC(=CC2=CC=C(C=C2)N3CCCC3)C1=O)NC4=CC=CC=C4
ETHYL(5Z)2ANILINO4OXO5((4PYRROLIDIN1YLPHENYL)METHYLIDENE)THIOPHENE3CARBOXYLATE
ethyl(5Z)4oxo2(phenylamino)5(4(pyrrolidin1yl)benzylidene)45dihydrothiophene3carboxylate
InChI=1SC24H24N2O3Sc122924(28)2122(27)20(3023(21)25188435918)1617101219(131117)2614671526h358131625H2671415H21H3b2016
MFCD03711216
ZINC000004845663
ZINC04845663
ZINC4845663
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