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Vitas-M small molecule compound

ethyl 2-{[(2E)-2-cyano-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]amino}-4-(4-methylphenyl)thiophene-3-carboxylate

Catalog ID
STK952737
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)/C(=C/c1ccc(c(c1)OC)O)/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 C25H22N2O5S MW 462.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O5S/c1-4-32-25(30)22-19(17-8-5-15(2)6-9-17)14-33-24(22)27-23(29)18(13-26)11-16-7-10-20(28)21(12-16)31-3/h5-12,14,28H,4H2,1-3H3,(H,27,29)/b18-11+
InChIKey
MBAIMMGUMAISCU-WOJGMQOQSA-N
Synonyms
1164555-83-2
(E)ethyl2(2cyano3(4hydroxy3methoxyphenyl)acrylamido)4(ptolyl)thiophene3carboxylate
1164555832
2(((E)2CYANO3(4HYDROXY3METHOXYPHENYL)1OXOPROP2ENYL)AMINO)4(4METHYLPHENYL)3THIOPHENECARBOXYLICACIDETHYLESTER
2(((E)2CYANO3(4HYDROXY3METHOXYPHENYL)ACRYLOYL)AMINO)4(PTOLYL)THIOPHENE3CARBOXYLICACIDETHYLESTER
2((E)2CYANO3(4HYDROXY3METHOXYPHENYL)ACRYLOYLAMINO)4PTOLYLTHIOPHENE3CARBOXYLICACIDETHYLESTER
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C(=CC3=CC(=C(C=C3)O)OC)C#N
CCOC(=O)c1c(scc1c1ccc(cc1)C)NC(=O)C(=Cc1ccc(c(c1)OC)O)C#N
ethyl2(((2E)2cyano3(4hydroxy3methoxyphenyl)prop2enoyl)amino)4(4methylphenyl)thiophene3carboxylate
ETHYL2(((E)2CYANO3(3METHOXY4OXIDANYLPHENYL)PROP2ENOYL)AMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
ETHYL2(((E)2CYANO3(4HYDROXY3METHOXYPHENYL)PROP2ENOYL)AMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
ETHYL2((2E)2CYANO3(4HYDROXY3METHOXYPHENYL)PROP2ENOYLAMINO)4(4METHYLPHENYL)THIOPHENE3CARBOXYLATE
InChI=1SC25H22N2O5Sc143225(30)2219(178515(2)6917)143324(22)2723(29)18(1326)111671020(28)21(1216)313h5121428H4H213H3(H2729)b1811+
MFCD02957168
ZINC000002320913
ZINC02320913
ZINC2320913

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Available files

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