N-[4,5-dimethyl-3-[(4-phenylpiperazin-1-yl)-pyridin-3-yl-methyl]thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[4,5-dimethyl-3-[(4-phenylpiperazin-1-yl)-pyridin-3-yl-methyl]thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[4,5-dimethyl-3-[(4-phenylpiperazin-1-yl)-(3-pyridyl)methyl]-2-thienyl]furan-2-carboxamide CAS Name: N-[4,5-dimethyl-3-[(4-phenyl-1-piperazinyl)-(3-pyridinyl)methyl]-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[4,5-dimethyl-3-[(4-phenylpiperazin-1-yl)-pyridin-3-ylmethyl]thiophen-2-yl]furan-2-carboxamide Traditional Name: N-[4,5-dimethyl-3-[(4-phenylpiperazino)-(3-pyridyl)methyl]-2-thienyl]-2-furamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CN=CC=C2)N3CCN(CC3)C4=CC=CC=C4)NC(=O)C5=CC=CO5)C

Isomeric SMILES

CC1=C(SC(=C1C(C2=CN=CC=C2)N3CCN(CC3)C4=CC=CC=C4)NC(=O)C5=CC=CO5)C

InChI

InChI=1S/C27H28N4O2S/c1-19-20(2)34-27(29-26(32)23-11-7-17-33-23)24(19)25(21-8-6-12-28-18-21)31-15-13-30(14-16-31)22-9-4-3-5-10-22/h3-12,17-18,25H,13-16H2,1-2H3,(H,29,32)