ethanedioic acid; N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-5-pyridin-2-yl-thiophene-2-carboxamide

Systemtic Name: ethanedioic acid; N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-5-pyridin-2-yl-thiophene-2-carboxamide Openeye Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-5-(2-pyridyl)thiophene-2-carboxamide; oxalic acid CAS Name: N-[4-methoxy-3-(4-methyl-1-piperazinyl)phenyl]-5-(2-pyridinyl)-2-thiophenecarboxamide; oxalic acid IUPAC Name: N-[4-methoxy-3-(4-methylpiperazin-1-yl)phenyl]-5-pyridin-2-ylthiophene-2-carboxamide; oxalic acid Traditional Name: N-[4-methoxy-3-(4-methylpiperazino)phenyl]-5-(2-pyridyl)thiophene-2-carboxamide; oxalic acid Formula: C24H26N4O6S MolecularWeight: 498.55144

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)C3=CC=C(S3)C4=CC=CC=N4)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC(=C2)NC(=O)C3=CC=C(S3)C4=CC=CC=N4)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H24N4O2S.C2H2O4/c1-25-11-13-26(14-12-25)18-15-16(6-7-19(18)28-2)24-22(27)21-9-8-20(29-21)17-5-3-4-10-23-17;3-1(4)2(5)6/h3-10,15H,11-14H2,1-2H3,(H,24,27);(H,3,4)(H,5,6)