Vitas-M small molecule compound
(2E)-3-(furan-2-yl)-N-({4-[4-(2-methylpropanoyl)piperazin-1-yl]phenyl}carbamothioyl)prop-2-enamide
Catalog ID
STL377682
SMILES S=C(Nc1ccc(cc1)N1CCN(CC1)C(=O)C(C)C)NC(=O)/C=C/c1ccco1
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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 C22H26N4O3S MW 426.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O3S/c1-16(2)21(28)26-13-11-25(12-14-26)18-7-5-17(6-8-18)23-22(30)24-20(27)10-9-19-4-3-15-29-19/h3-10,15-16H,11-14H2,1-2H3,(H2,23,24,27,30)/b10-9+InChIKey
GAYWDGZFMOOYRU-MDZDMXLPSA-NSynonyms
(2E)3(furan2yl)N((4(4(2methylpropanoyl)piperazin1yl)phenyl)carbamothioyl)prop2enamide
(E)3(FURAN2YL)N((4(4(2METHYLPROPANOYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)PROP2ENAMIDE
CC(C)C(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C=CC3=CC=CO3
InChI=1SC22H26N4O3Sc116(2)21(28)26131125(121426)187517(6818)2322(30)2420(27)1091943152919h3101516H1114H212H3(H223242730)b109+
MFCD04075715
N(3(2FURYL)ACRYLOYL)N(4(4ISOBUTYRYL1PIPERAZINYL)PHENYL)THIOUREA
S=C(Nc1ccc(cc1)N1CCN(CC1)C(=O)C(C)C)NC(=O)C=Cc1ccco1
ZINC000016574916
ZINC16574916
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