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

Systemtic Name: N-[3-[phenyl-(4-phenylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[phenyl-(4-phenylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]furan-2-carboxamide CAS Name: N-[3-[phenyl-(4-phenyl-1-piperazinyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-furancarboxamide IUPAC Name: N-[3-[phenyl-(4-phenylpiperazin-1-yl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[phenyl-(4-phenylpiperazino)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-furamide Formula: C30H31N3O2S MolecularWeight: 497.65104

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CO3)C(C4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CO3)C(C4=CC=CC=C4)N5CCN(CC5)C6=CC=CC=C6

InChI

InChI=1S/C30H31N3O2S/c34-29(25-15-9-21-35-25)31-30-27(24-14-7-8-16-26(24)36-30)28(22-10-3-1-4-11-22)33-19-17-32(18-20-33)23-12-5-2-6-13-23/h1-6,9-13,15,21,28H,7-8,14,16-20H2,(H,31,34)