N-[3-[(4-methylpiperazin-1-yl)-phenyl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[3-[(4-methylpiperazin-1-yl)-phenyl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[(4-methylpiperazin-1-yl)-phenyl-methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]furan-2-carboxamide CAS Name: N-[3-[(4-methyl-1-piperazinyl)-phenylmethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-furancarboxamide IUPAC Name: N-[3-[(4-methylpiperazin-1-yl)-phenylmethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[(4-methylpiperazino)-phenyl-methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-furamide Formula: C25H29N3O2S MolecularWeight: 435.58166

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(C2=CC=CC=C2)C3=C(SC4=C3CCCC4)NC(=O)C5=CC=CO5

Isomeric SMILES

CN1CCN(CC1)C(C2=CC=CC=C2)C3=C(SC4=C3CCCC4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C25H29N3O2S/c1-27-13-15-28(16-14-27)23(18-8-3-2-4-9-18)22-19-10-5-6-12-21(19)31-25(22)26-24(29)20-11-7-17-30-20/h2-4,7-9,11,17,23H,5-6,10,12-16H2,1H3,(H,26,29)