ethanedioic acid; N-[2-[(2-methylphenyl)methylamino]propyl]-N-thiophen-2-yl-propanamide

Systemtic Name: ethanedioic acid; N-[2-[(2-methylphenyl)methylamino]propyl]-N-thiophen-2-yl-propanamide Openeye Name: N-[2-(o-tolylmethylamino)propyl]-N-(2-thienyl)propanamide; oxalic acid CAS Name: N-[2-[(2-methylphenyl)methylamino]propyl]-N-thiophen-2-ylpropanamide; oxalic acid IUPAC Name: N-[2-[(2-methylphenyl)methylamino]propyl]-N-thiophen-2-ylpropanamide; oxalic acid Traditional Name: N-[2-[(2-methylbenzyl)amino]propyl]-N-(2-thienyl)propionamide; oxalic acid Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC(C)NCC1=CC=CC=C1C)C2=CC=CS2.C(=O)(C(=O)O)O

Isomeric SMILES

CCC(=O)N(CC(C)NCC1=CC=CC=C1C)C2=CC=CS2.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H24N2OS.C2H2O4/c1-4-17(21)20(18-10-7-11-22-18)13-15(3)19-12-16-9-6-5-8-14(16)2;3-1(4)2(5)6/h5-11,15,19H,4,12-13H2,1-3H3;(H,3,4)(H,5,6)