N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-1-ethyl-piperidin-4-amine; ethanedioic acid

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-1-ethyl-piperidin-4-amine; ethanedioic acid Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methyl]-1-ethyl-piperidin-4-amine; oxalic acid CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methyl]-1-ethyl-4-piperidinamine; oxalic acid IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-1-ethylpiperidin-4-amine; oxalic acid Traditional Name: [5-(1,3-benzothiazol-2-yl)-2-furyl]methyl-(1-ethyl-4-piperidyl)amine; oxalic acid Formula: C23H27N3O9S MolecularWeight: 521.54018

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(CC1)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCC(CC1)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23N3OS.2C2H2O4/c1-2-22-11-9-14(10-12-22)20-13-15-7-8-17(23-15)19-21-16-5-3-4-6-18(16)24-19;2*3-1(4)2(5)6/h3-8,14,20H,2,9-13H2,1H3;2*(H,3,4)(H,5,6)