N-[4-[3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-6-oxidanyl-1-benzothiophen-2-yl]phenyl]benzenesulfonamide

Systemtic Name: N-[4-[3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-6-oxidanyl-1-benzothiophen-2-yl]phenyl]benzenesulfonamide Openeye Name: N-[4-[6-hydroxy-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzothiophen-2-yl]phenyl]benzenesulfonamide CAS Name: N-[4-[6-hydroxy-3-[[3-methoxy-4-(1-pyrrolidinylmethyl)phenyl]methyl]-1-benzothiophen-2-yl]phenyl]benzenesulfonamide IUPAC Name: N-[4-[6-hydroxy-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-2-yl]phenyl]benzenesulfonamide Traditional Name: N-[4-[6-hydroxy-3-[3-methoxy-4-(pyrrolidinomethyl)benzyl]benzothiophen-2-yl]phenyl]benzenesulfonamide Formula: C33H32N2O4S2 MolecularWeight: 584.74818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=CC=C5)CN6CCCC6

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=CC=C5)CN6CCCC6

InChI

InChI=1S/C33H32N2O4S2/c1-39-31-20-23(9-10-25(31)22-35-17-5-6-18-35)19-30-29-16-15-27(36)21-32(29)40-33(30)24-11-13-26(14-12-24)34-41(37,38)28-7-3-2-4-8-28/h2-4,7-16,20-21,34,36H,5-6,17-19,22H2,1H3