Vitas-M small molecule compound
ethyl 2-({(2E)-3-[1-(2-amino-2-oxoethyl)-1H-indol-3-yl]-2-cyanoprop-2-enoyl}amino)-5-(propan-2-yl)thiophene-3-carboxylate
Catalog ID
STK473611
SMILES CCOC(=O)c1cc(sc1NC(=O)/C(=C/c1cn(c2c1cccc2)CC(=O)N)/C#N)C(C)C
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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 C24H24N4O4S MW 464.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O4S/c1-4-32-24(31)18-10-20(14(2)3)33-23(18)27-22(30)15(11-25)9-16-12-28(13-21(26)29)19-8-6-5-7-17(16)19/h5-10,12,14H,4,13H2,1-3H3,(H2,26,29)(H,27,30)/b15-9+InChIKey
KVFLZHHUXYHOFV-OQLLNIDSSA-NSynonyms
CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)C(=CC2=CN(C3=CC=CC=C32)CC(=O)N)C#N
CCOC(=O)c1cc(sc1NC(=O)C(=Cc1cn(c2c1cccc2)CC(=O)N)C#N)C(C)C
ethyl2(((2E)3(1(2amino2oxoethyl)1Hindol3yl)2cyanoprop2enoyl)amino)5(propan2yl)thiophene3carboxylate
ethyl2(((E)3(1(2amino2oxoethyl)indol3yl)2cyanoprop2enoyl)amino)5propan2ylthiophene3carboxylate
ETHYL2((2E)3(1(CARBAMOYLMETHYL)INDOL3YL)2CYANOPROP2ENOYLAMINO)5(METHYLETHYL)THIOPHENE3CARBOXYLATE
InChI=1SC24H24N4O4Sc143224(31)181020(14(2)3)3323(18)2722(30)15(1125)9161228(1321(26)29)19865717(16)19h5101214H413H213H3(H22629)(H2730)b159+
MFCD07077781
ZINC000020168618
ZINC20168618
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