N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: N-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanyl-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: N-[2-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]benzothiophene-2-carboxamide CAS Name: N-[2-hydroxy-2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[2-hydroxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]-1-benzothiophene-2-carboxamide Traditional Name: N-[2-hydroxy-2-[4-(2-methoxyphenyl)piperazino]ethyl]benzothiophene-2-carboxamide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(CNC(=O)C3=CC4=CC=CC=C4S3)O

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(CNC(=O)C3=CC4=CC=CC=C4S3)O

InChI

InChI=1S/C22H25N3O3S/c1-28-18-8-4-3-7-17(18)24-10-12-25(13-11-24)21(26)15-23-22(27)20-14-16-6-2-5-9-19(16)29-20/h2-9,14,21,26H,10-13,15H2,1H3,(H,23,27)