Vitas-M small molecule compound
2-({(2E)-2-cyano-3-[4-(dimethylamino)phenyl]prop-2-enoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Catalog ID
STL333542
SMILES N#C/C(=C\c1ccc(cc1)N(C)C)/C(=O)Nc1sc2c(c1C(=O)N)CCCC2
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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 C21H22N4O2S MW 394.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O2S/c1-25(2)15-9-7-13(8-10-15)11-14(12-22)20(27)24-21-18(19(23)26)16-5-3-4-6-17(16)28-21/h7-11H,3-6H2,1-2H3,(H2,23,26)(H,24,27)/b14-11+InChIKey
ZRBQTWCLYKHVFR-SDNWHVSQSA-NSynonyms
327061-88-1(E)2(2cyano3(4(dimethylamino)phenyl)acrylamido)4567tetrahydrobenzo(b)thiophene3carboxamide
2(((2E)2cyano3(4(dimethylamino)phenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxamide
2(((E)2cyano3(4(dimethylamino)phenyl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxamide
327061881
CN(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)N
InChI=1SC21H22N4O2Sc125(2)159713(81015)1114(1222)20(27)242118(19(23)26)16534617(16)2821h711H36H212H3(H22326)(H2427)b1411+
MFCD02354350
N#CC(=Cc1ccc(cc1)N(C)C)C(=O)Nc1sc2c(c1C(=O)N)CCCC2
ZINC000002329860
ZINC02329860
ZINC2329860
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