N-[2-(4-phenylpiperazin-1-yl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-yl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[2-(4-phenylpiperazin-1-yl)ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[2-(4-phenyl-1-piperazinyl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[2-(4-phenylpiperazin-1-yl)ethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[2-(4-phenylpiperazino)ethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=CS2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C(=CS2)C(=O)NCCN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H27N3OS/c25-21(19-16-26-20-9-5-4-8-18(19)20)22-10-11-23-12-14-24(15-13-23)17-6-2-1-3-7-17/h1-3,6-7,16H,4-5,8-15H2,(H,22,25)