ethanedioic acid; N-methyl-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-N-(thiophen-3-ylmethyl)ethanamide

Systemtic Name: ethanedioic acid; N-methyl-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-N-(thiophen-3-ylmethyl)ethanamide Openeye Name: N-methyl-2-[4-(1-naphthylmethyl)piperazin-1-yl]-N-(3-thienylmethyl)acetamide; oxalic acid CAS Name: N-methyl-2-[4-(1-naphthalenylmethyl)-1-piperazinyl]-N-(3-thiophenylmethyl)acetamide; oxalic acid IUPAC Name: N-methyl-2-[4-(naphthalen-1-ylmethyl)piperazin-1-yl]-N-(thiophen-3-ylmethyl)acetamide; oxalic acid Traditional Name: N-methyl-2-[4-(1-naphthylmethyl)piperazino]-N-(3-thenyl)acetamide; oxalic acid Formula: C27H31N3O9S MolecularWeight: 573.61474

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CSC=C1)C(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

CN(CC1=CSC=C1)C(=O)CN2CCN(CC2)CC3=CC=CC4=CC=CC=C43.C(=O)(C(=O)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H27N3OS.2C2H2O4/c1-24(15-19-9-14-28-18-19)23(27)17-26-12-10-25(11-13-26)16-21-7-4-6-20-5-2-3-8-22(20)21;2*3-1(4)2(5)6/h2-9,14,18H,10-13,15-17H2,1H3;2*(H,3,4)(H,5,6)