(4-phenylmethoxypiperidin-1-yl)-(2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone

Systemtic Name: (4-phenylmethoxypiperidin-1-yl)-(2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone Openeye Name: (4-benzyloxy-1-piperidyl)-(2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophen-3-yl)methanone CAS Name: (4-phenylmethoxy-1-piperidinyl)-[2-(1-pyrrolyl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]methanone IUPAC Name: (4-phenylmethoxypiperidin-1-yl)-(2-pyrrol-1-yl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)methanone Traditional Name: (4-benzoxypiperidino)-(2-pyrrol-1-yl-4,5,6,7-tetrahydrobenzothiophen-3-yl)methanone Formula: C25H28N2O2S MolecularWeight: 420.56702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)N3C=CC=C3)C(=O)N4CCC(CC4)OCC5=CC=CC=C5

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)N3C=CC=C3)C(=O)N4CCC(CC4)OCC5=CC=CC=C5

InChI

InChI=1S/C25H28N2O2S/c28-24(26-16-12-20(13-17-26)29-18-19-8-2-1-3-9-19)23-21-10-4-5-11-22(21)30-25(23)27-14-6-7-15-27/h1-3,6-9,14-15,20H,4-5,10-13,16-18H2