(E)-but-2-enedioic acid; N-[4-(furan-2-yl)-5-piperazin-1-yl-1,3-thiazol-2-yl]ethanamide

Systemtic Name: (E)-but-2-enedioic acid; N-[4-(furan-2-yl)-5-piperazin-1-yl-1,3-thiazol-2-yl]ethanamide Openeye Name: fumaric acid; N-[4-(2-furyl)-5-piperazin-1-yl-thiazol-2-yl]acetamide CAS Name: (E)-2-butenedioic acid; N-[4-(2-furanyl)-5-(1-piperazinyl)-2-thiazolyl]acetamide IUPAC Name: (E)-but-2-enedioic acid; N-[4-(furan-2-yl)-5-piperazin-1-yl-1,3-thiazol-2-yl]acetamide Traditional Name: fumaric acid; N-[4-(2-furyl)-5-piperazino-thiazol-2-yl]acetamide Formula: C17H20N4O6S MolecularWeight: 408.4289

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=C(S1)N2CCNCC2)C3=CC=CO3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)NC1=NC(=C(S1)N2CCNCC2)C3=CC=CO3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C13H16N4O2S.C4H4O4/c1-9(18)15-13-16-11(10-3-2-8-19-10)12(20-13)17-6-4-14-5-7-17;5-3(6)1-2-4(7)8/h2-3,8,14H,4-7H2,1H3,(H,15,16,18);1-2H,(H,5,6)(H,7,8)/b;2-1+