2-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-6-ol

Systemtic Name: 2-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-6-ol Openeye Name: 2-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzothiophen-6-ol CAS Name: 2-[4-(1-pyrrolidinylmethyl)phenyl]-3-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]-1-benzothiophen-6-ol IUPAC Name: 2-[4-(pyrrolidin-1-ylmethyl)phenyl]-3-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-1-benzothiophen-6-ol Traditional Name: 3-[4-(pyrrolidinomethyl)benzyl]-2-[4-(pyrrolidinomethyl)phenyl]benzothiophen-6-ol Formula: C31H34N2OS MolecularWeight: 482.67946

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CC3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)CN6CCCC6

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CC3=C(SC4=C3C=CC(=C4)O)C5=CC=C(C=C5)CN6CCCC6

InChI

InChI=1S/C31H34N2OS/c34-27-13-14-28-29(19-23-5-7-24(8-6-23)21-32-15-1-2-16-32)31(35-30(28)20-27)26-11-9-25(10-12-26)22-33-17-3-4-18-33/h5-14,20,34H,1-4,15-19,21-22H2