Vitas-M small molecule compound
methyl 2-{[(2E)-2-cyano-3-{5-[(2-methylphenoxy)methyl]furan-2-yl}prop-2-enoyl]amino}-5-(propan-2-yl)thiophene-3-carboxylate
Catalog ID
STK472676
SMILES N#C/C(=C\c1ccc(o1)COc1ccccc1C)/C(=O)Nc1sc(cc1C(=O)OC)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 C25H24N2O5S MW 464.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O5S/c1-15(2)22-12-20(25(29)30-4)24(33-22)27-23(28)17(13-26)11-18-9-10-19(32-18)14-31-21-8-6-5-7-16(21)3/h5-12,15H,14H2,1-4H3,(H,27,28)/b17-11+InChIKey
URUOUXYZVFLJLK-GZTJUZNOSA-NSynonyms
CC1=CC=CC=C1OCC2=CC=C(O2)C=C(C#N)C(=O)NC3=C(C=C(S3)C(C)C)C(=O)OC
InChI=1SC25H24N2O5Sc115(2)221220(25(29)304)24(3322)2723(28)17(1326)111891019(3218)143121865716(21)3h51215H14H214H3(H2728)b1711+
methyl2(((2E)2cyano3(5((2methylphenoxy)methyl)furan2yl)prop2enoyl)amino)5(propan2yl)thiophene3carboxylate
methyl2(((E)2cyano3(5((2methylphenoxy)methyl)furan2yl)prop2enoyl)amino)5propan2ylthiophene3carboxylate
METHYL2((2E)2CYANO3(5((2METHYLPHENOXY)METHYL)(2FURYL))PROP2ENOYLAMINO)5(METHYLETHYL)THIOPHENE3CARBOXYLATE
MFCD07093525
N#CC(=Cc1ccc(o1)COc1ccccc1C)C(=O)Nc1sc(cc1C(=O)OC)C(C)C
ZINC000020419057
ZINC20419057
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