4-[4-[5-methoxy-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-2-yl]phenoxy]butan-1-ol

Systemtic Name: 4-[4-[5-methoxy-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-2-yl]phenoxy]butan-1-ol Openeye Name: 4-[4-[5-methoxy-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzothiophen-2-yl]phenoxy]butan-1-ol CAS Name: 4-[4-[5-methoxy-3-[[3-methoxy-4-(1-pyrrolidinylmethyl)phenyl]methyl]-1-benzothiophen-2-yl]phenoxy]-1-butanol IUPAC Name: 4-[4-[5-methoxy-3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-2-yl]phenoxy]butan-1-ol Traditional Name: 4-[4-[5-methoxy-3-[3-methoxy-4-(pyrrolidinomethyl)benzyl]benzothiophen-2-yl]phenoxy]butan-1-ol Formula: C32H37NO4S MolecularWeight: 531.70548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC(=C2CC3=CC(=C(C=C3)CN4CCCC4)OC)C5=CC=C(C=C5)OCCCCO

Isomeric SMILES

COC1=CC2=C(C=C1)SC(=C2CC3=CC(=C(C=C3)CN4CCCC4)OC)C5=CC=C(C=C5)OCCCCO

InChI

InChI=1S/C32H37NO4S/c1-35-27-13-14-31-28(21-27)29(32(38-31)24-9-11-26(12-10-24)37-18-6-5-17-34)19-23-7-8-25(30(20-23)36-2)22-33-15-3-4-16-33/h7-14,20-21,34H,3-6,15-19,22H2,1-2H3