Vitas-M small molecule compound
2-{[(2E)-3-phenylprop-2-enoyl]amino}-N-(prop-2-en-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STK897103
SMILES C=CCNC(=O)c1c(NC(=O)/C=C/c2ccccc2)sc2c1CCCC2
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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 C21H22N2O2S MW 366.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O2S/c1-2-14-22-20(25)19-16-10-6-7-11-17(16)26-21(19)23-18(24)13-12-15-8-4-3-5-9-15/h2-5,8-9,12-13H,1,6-7,10-11,14H2,(H,22,25)(H,23,24)/b13-12+InChIKey
JIDZMQUJGZBCRU-OUKQBFOZSA-NSynonyms
2(((2E)3phenylprop2enoyl)amino)N(prop2en1yl)4567tetrahydro1benzothiophene3carboxamide
2(((E)3phenylprop2enoyl)amino)Nprop2enyl4567tetrahydro1benzothiophene3carboxamide
C=CCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C=CC3=CC=CC=C3
C=CCNC(=O)c1c(NC(=O)C=Cc2ccccc2)sc2c1CCCC2
InChI=1SC21H22N2O2Sc12142220(25)191610671117(16)2621(19)2318(24)1312158435915h25891213H167101114H2(H2225)(H2324)b1312+
MFCD02978246
ZINC000002677509
ZINC02677509
ZINC2677509
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