Vitas-M small molecule compound
methyl 5-(diethylcarbamoyl)-4-methyl-2-{[(2E)-3-phenylprop-2-enoyl]amino}thiophene-3-carboxylate
Catalog ID
STK429141
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)/C=C/c1ccccc1)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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-5-23(6-2)20(25)18-14(3)17(21(26)27-4)19(28-18)22-16(24)13-12-15-10-8-7-9-11-15/h7-13H,5-6H2,1-4H3,(H,22,24)/b13-12+InChIKey
AJALYJFCQLBQQZ-OUKQBFOZSA-NSynonyms
CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=O)C=Cc1ccccc1)CC
CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C=CC2=CC=CC=C2)C(=O)OC)C
InChI=1SC21H24N2O4Sc1523(62)20(25)1814(3)17(21(26)274)19(2818)2216(24)131215108791115h713H56H214H3(H2224)b1312+
METHYL2((2E)3PHENYLPROP2ENOYLAMINO)5(NNDIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL2(CINNAMOYLAMINO)5((DIETHYLAMINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
methyl5(diethylcarbamoyl)4methyl2(((2E)3phenylprop2enoyl)amino)thiophene3carboxylate
METHYL5(DIETHYLCARBAMOYL)4METHYL2(((E)3PHENYLPROP2ENOYL)AMINO)THIOPHENE3CARBOXYLATE
MFCD01338490
ZINC000000994700
ZINC00994700
ZINC994700
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