Vitas-M small molecule compound
methyl 3-{[(2E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino}thiophene-2-carboxylate
Catalog ID
STK427608
SMILES COC(=O)c1sccc1NC(=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 C19H21NO3S MW 343.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21NO3S/c1-19(2,3)14-8-5-13(6-9-14)7-10-16(21)20-15-11-12-24-17(15)18(22)23-4/h5-12H,1-4H3,(H,20,21)/b10-7+InChIKey
XKCQULCITNGAHQ-JXMROGBWSA-NSynonyms
CC(C)(C)C1=CC=C(C=C1)C=CC(=O)NC2=C(SC=C2)C(=O)OC
COC(=O)c1sccc1NC(=O)C=Cc1ccc(cc1)C(C)(C)C
InChI=1SC19H21NO3Sc119(23)148513(6914)71016(21)201511122417(15)18(22)234h512H14H3(H2021)b107+
methyl3(((2E)3(4tertbutylphenyl)prop2enoyl)amino)thiophene2carboxylate
METHYL3(((E)3(4TERTBUTYLPHENYL)PROP2ENOYL)AMINO)THIOPHENE2CARBOXYLATE
METHYL3((2E)3(4(TERTBUTYL)PHENYL)PROP2ENOYLAMINO)THIOPHENE2CARBOXYLATE
METHYL3((3(4TERTBUTYLPHENYL)ACRYLOYL)AMINO)2THIOPHENECARBOXYLATE
MFCD01345076
ZINC000000433744
ZINC00433744
ZINC433744
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