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

Systemtic Name: N-[3-[(4-methylsulfanylphenyl)-piperidin-1-yl-methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[(4-methylsulfanylphenyl)-(1-piperidyl)methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]furan-2-carboxamide CAS Name: N-[3-[[4-(methylthio)phenyl]-(1-piperidinyl)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-furancarboxamide IUPAC Name: N-[3-[(4-methylsulfanylphenyl)-piperidin-1-ylmethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[[4-(methylthio)phenyl]-piperidino-methyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-furamide Formula: C26H30N2O2S2 MolecularWeight: 466.6586

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CO4)N5CCCCC5

Isomeric SMILES

CSC1=CC=C(C=C1)C(C2=C(SC3=C2CCCC3)NC(=O)C4=CC=CO4)N5CCCCC5

InChI

InChI=1S/C26H30N2O2S2/c1-31-19-13-11-18(12-14-19)24(28-15-5-2-6-16-28)23-20-8-3-4-10-22(20)32-26(23)27-25(29)21-9-7-17-30-21/h7,9,11-14,17,24H,2-6,8,10,15-16H2,1H3,(H,27,29)