N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Systemtic Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Openeye Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide CAS Name: N-[3-[4-(4-methoxyphenyl)-1-piperazinyl]propyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide IUPAC Name: N-[3-[4-(4-methoxyphenyl)piperazin-1-yl]propyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Traditional Name: N-[3-[4-(4-methoxyphenyl)piperazino]propyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=CSC4=C3CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCCNC(=O)C3=CSC4=C3CCCC4

InChI

InChI=1S/C23H31N3O2S/c1-28-19-9-7-18(8-10-19)26-15-13-25(14-16-26)12-4-11-24-23(27)21-17-29-22-6-3-2-5-20(21)22/h7-10,17H,2-6,11-16H2,1H3,(H,24,27)