Vitas-M small molecule compound
methyl 2-{[(2E)-2-cyano-3-{4-[2-(morpholin-4-yl)ethoxy]phenyl}prop-2-enoyl]amino}-5-propylthiophene-3-carboxylate
Catalog ID
STK472829
SMILES CCCc1sc(c(c1)C(=O)OC)NC(=O)/C(=C/c1ccc(cc1)OCCN1CCOCC1)/C#N
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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 C25H29N3O5S MW 483.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O5S/c1-3-4-21-16-22(25(30)31-2)24(34-21)27-23(29)19(17-26)15-18-5-7-20(8-6-18)33-14-11-28-9-12-32-13-10-28/h5-8,15-16H,3-4,9-14H2,1-2H3,(H,27,29)/b19-15+InChIKey
XHNYIHCXXDWKFZ-XDJHFCHBSA-NSynonyms
CCCC1=CC(=C(S1)NC(=O)C(=CC2=CC=C(C=C2)OCCN3CCOCC3)C#N)C(=O)OC
CCCc1sc(c(c1)C(=O)OC)NC(=O)C(=Cc1ccc(cc1)OCCN1CCOCC1)C#N
InChI=1SC25H29N3O5Sc134211622(25(30)312)24(3421)2723(29)19(1726)15185720(8618)3314112891232131028h581516H34914H212H3(H2729)b1915+
methyl2(((2E)2cyano3(4(2(morpholin4yl)ethoxy)phenyl)prop2enoyl)amino)5propylthiophene3carboxylate
methyl2(((E)2cyano3(4(2morpholin4ylethoxy)phenyl)prop2enoyl)amino)5propylthiophene3carboxylate
METHYL2((2E)2CYANO3(4(2MORPHOLIN4YLETHOXY)PHENYL)PROP2ENOYLAMINO)5PROPYLTHIOPHENE3CARBOXYLATE
MFCD07077790
ZINC000020572762
ZINC20572762
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