Vitas-M small molecule compound
propan-2-yl 5-(diethylcarbamoyl)-2-{[(2E)-3-(furan-2-yl)prop-2-enoyl]amino}-4-methylthiophene-3-carboxylate
Catalog ID
STK435424
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)/C=C/c1ccco1)CC
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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 C21H26N2O5S MW 418.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N2O5S/c1-6-23(7-2)20(25)18-14(5)17(21(26)28-13(3)4)19(29-18)22-16(24)11-10-15-9-8-12-27-15/h8-13H,6-7H2,1-5H3,(H,22,24)/b11-10+InChIKey
DKXHLPLLZLPSQD-ZHACJKMWSA-NSynonyms
CCN(C(=O)c1sc(c(c1C)C(=O)OC(C)C)NC(=O)C=Cc1ccco1)CC
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C=CC2=CC=CO2)C(=O)OC(C)C)C
InChI=1SC21H26N2O5Sc1623(72)20(25)1814(5)17(21(26)2813(3)4)19(2918)2216(24)11101598122715h813H67H215H3(H2224)b1110+
ISOPROPYL5((DIETHYLAMINO)CARBONYL)2((3(2FURYL)ACRYLOYL)AMINO)4METHYL3THIOPHENECARBOXYLATE
METHYLETHYL2((2E)3(2FURYL)PROP2ENOYLAMINO)5(NNDIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03375552
propan2yl5(diethylcarbamoyl)2(((2E)3(furan2yl)prop2enoyl)amino)4methylthiophene3carboxylate
PROPAN2YL5(DIETHYLCARBAMOYL)2(((E)3(FURAN2YL)PROP2ENOYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
ZINC000000671715
ZINC00671715
ZINC671715
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.