Vitas-M small molecule compound
ethyl (5Z)-5-(1H-indol-3-ylmethylidene)-4-oxo-2-(phenylamino)-4,5-dihydrothiophene-3-carboxylate
Catalog ID
STK792326
SMILES CCOC(=O)C1=C(Nc2ccccc2)S/C(=C\c2c[nH]c3c2cccc3)/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 C22H18N2O3S MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O3S/c1-2-27-22(26)19-20(25)18(28-21(19)24-15-8-4-3-5-9-15)12-14-13-23-17-11-7-6-10-16(14)17/h3-13,23-24H,2H2,1H3/b18-12-InChIKey
GUBCFEMOYXCCSS-PDGQHHTCSA-NSynonyms
CCOC(=O)C1=C(Nc2ccccc2)SC(=Cc2c(nH)c3c2cccc3)C1=O
CCOC(=O)C1=C(SC(=CC2=CNC3=CC=CC=C32)C1=O)NC4=CC=CC=C4
ETHYL(5Z)2ANILINO5(1HINDOL3YLMETHYLIDENE)4OXOTHIOPHENE3CARBOXYLATE
ethyl(5Z)5(1Hindol3ylmethylidene)4oxo2(phenylamino)45dihydrothiophene3carboxylate
ETHYL2ANILINO5(1HINDOL3YLMETHYLENE)4OXO45DIHYDRO3THIOPHENECARBOXYLATE
InChI=1SC22H18N2O3Sc122722(26)1920(25)18(2821(19)24158435915)121413231711761016(14)17h3132324H2H21H3b1812
MFCD03712339
ZINC000019804821
ZINC19804821
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