Vitas-M small molecule compound
methyl 5-{[(2E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino}-4-carbamoyl-3-methylthiophene-2-carboxylate
Catalog ID
STK424856
SMILES COC(=O)c1sc(c(c1C)C(=O)N)NC(=O)/C=C/c1ccc(cc1)C(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 C21H24N2O4S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O4S/c1-12-16(18(22)25)19(28-17(12)20(26)27-5)23-15(24)11-8-13-6-9-14(10-7-13)21(2,3)4/h6-11H,1-5H3,(H2,22,25)(H,23,24)/b11-8+InChIKey
OCFQLMAGQFEZMP-DHZHZOJOSA-NSynonyms
CC1=C(SC(=C1C(=O)N)NC(=O)C=CC2=CC=C(C=C2)C(C)(C)C)C(=O)OC
COC(=O)c1sc(c(c1C)C(=O)N)NC(=O)C=Cc1ccc(cc1)C(C)(C)C
InChI=1SC21H24N2O4Sc11216(18(22)25)19(2817(12)20(26)275)2315(24)118136914(10713)21(23)4h611H15H3(H22225)(H2324)b118+
methyl5(((2E)3(4tertbutylphenyl)prop2enoyl)amino)4carbamoyl3methylthiophene2carboxylate
METHYL5(((E)3(4TERTBUTYLPHENYL)PROP2ENOYL)AMINO)4CARBAMOYL3METHYLTHIOPHENE2CARBOXYLATE
METHYL5((2E)3(4(TERTBUTYL)PHENYL)PROP2ENOYLAMINO)4CARBAMOYL3METHYLTHIOPHENE2CARBOXYLATE
MFCD02372040
ZINC000000673172
ZINC00673172
ZINC673172
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