ethanedioic acid; 4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]-N-(3-piperidin-1-ylpropyl)benzamide

Systemtic Name: ethanedioic acid; 4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]-N-(3-piperidin-1-ylpropyl)benzamide Openeye Name: oxalic acid; N-[3-(1-piperidyl)propyl]-4-[2-(p-tolyl)thiazol-4-yl]benzamide CAS Name: 4-[2-(4-methylphenyl)-4-thiazolyl]-N-[3-(1-piperidinyl)propyl]benzamide; oxalic acid IUPAC Name: 4-[2-(4-methylphenyl)-1,3-thiazol-4-yl]-N-(3-piperidin-1-ylpropyl)benzamide; oxalic acid Traditional Name: oxalic acid; N-(3-piperidinopropyl)-4-[2-(p-tolyl)thiazol-4-yl]benzamide Formula: C27H31N3O5S MolecularWeight: 509.61714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)NCCCN4CCCCC4.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)C3=CC=C(C=C3)C(=O)NCCCN4CCCCC4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H29N3OS.C2H2O4/c1-19-6-8-22(9-7-19)25-27-23(18-30-25)20-10-12-21(13-11-20)24(29)26-14-5-17-28-15-3-2-4-16-28;3-1(4)2(5)6/h6-13,18H,2-5,14-17H2,1H3,(H,26,29);(H,3,4)(H,5,6)