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

Systemtic Name: N-[3-[(3,4-dimethoxyphenyl)-piperidin-1-yl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[(3,4-dimethoxyphenyl)-(1-piperidyl)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]furan-2-carboxamide CAS Name: N-[3-[(3,4-dimethoxyphenyl)-(1-piperidinyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-furancarboxamide IUPAC Name: N-[3-[(3,4-dimethoxyphenyl)-piperidin-1-ylmethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[(3,4-dimethoxyphenyl)-piperidino-methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-furamide Formula: C27H32N2O4S MolecularWeight: 480.61898

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CO4)N5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CO4)N5CCCCC5)OC

InChI

InChI=1S/C27H32N2O4S/c1-31-20-13-12-18(17-22(20)32-2)25(29-14-6-3-7-15-29)24-19-9-4-5-11-23(19)34-27(24)28-26(30)21-10-8-16-33-21/h8,10,12-13,16-17,25H,3-7,9,11,14-15H2,1-2H3,(H,28,30)