2-[6-pentylsulfonyl-2-(4-pentylsulfonylphenyl)-1-benzothiophen-3-yl]-4-(2-piperidin-1-ylethoxy)benzaldehyde

Systemtic Name: 2-[6-pentylsulfonyl-2-(4-pentylsulfonylphenyl)-1-benzothiophen-3-yl]-4-(2-piperidin-1-ylethoxy)benzaldehyde Openeye Name: 2-[6-pentylsulfonyl-2-(4-pentylsulfonylphenyl)benzothiophen-3-yl]-4-[2-(1-piperidyl)ethoxy]benzaldehyde CAS Name: 2-[6-pentylsulfonyl-2-(4-pentylsulfonylphenyl)-1-benzothiophen-3-yl]-4-[2-(1-piperidinyl)ethoxy]benzaldehyde IUPAC Name: 2-[6-pentylsulfonyl-2-(4-pentylsulfonylphenyl)-1-benzothiophen-3-yl]-4-(2-piperidin-1-ylethoxy)benzaldehyde Traditional Name: 2-[6-amylsulfonyl-2-(4-amylsulfonylphenyl)benzothiophen-3-yl]-4-(2-piperidinoethoxy)benzaldehyde Formula: C38H47NO6S3 MolecularWeight: 709.97788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)C1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)S(=O)(=O)CCCCC)C4=C(C=CC(=C4)OCCN5CCCCC5)C=O

Isomeric SMILES

CCCCCS(=O)(=O)C1=CC=C(C=C1)C2=C(C3=C(S2)C=C(C=C3)S(=O)(=O)CCCCC)C4=C(C=CC(=C4)OCCN5CCCCC5)C=O

InChI

InChI=1S/C38H47NO6S3/c1-3-5-10-24-47(41,42)32-16-13-29(14-17-32)38-37(34-19-18-33(27-36(34)46-38)48(43,44)25-11-6-4-2)35-26-31(15-12-30(35)28-40)45-23-22-39-20-8-7-9-21-39/h12-19,26-28H,3-11,20-25H2,1-2H3