(E)-but-2-enedioic acid; 2-pyrrolidin-3-yl-4H-indeno[1,2-d][1,3]thiazole

Systemtic Name: (E)-but-2-enedioic acid; 2-pyrrolidin-3-yl-4H-indeno[1,2-d][1,3]thiazole Openeye Name: fumaric acid; 2-pyrrolidin-3-yl-4H-indeno[1,2-d]thiazole CAS Name: (E)-2-butenedioic acid; 2-(3-pyrrolidinyl)-4H-indeno[1,2-d]thiazole IUPAC Name: (E)-but-2-enedioic acid; 2-pyrrolidin-3-yl-4H-indeno[1,2-d][1,3]thiazole Traditional Name: fumaric acid; 2-pyrrolidin-3-yl-4H-indeno[1,2-d]thiazole Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC1C2=NC3=C(S2)CC4=CC=CC=C43.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1CNCC1C2=NC3=C(S2)CC4=CC=CC=C43.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H14N2S.C4H4O4/c1-2-4-11-9(3-1)7-12-13(11)16-14(17-12)10-5-6-15-8-10;5-3(6)1-2-4(7)8/h1-4,10,15H,5-8H2;1-2H,(H,5,6)(H,7,8)/b;2-1+