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

Systemtic Name: 3-[[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-[6-(2-pyrrolidin-1-ylethoxy)pyridin-3-yl]-1-benzothiophen-6-ol Openeye Name: 3-[[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-[6-(2-pyrrolidin-1-ylethoxy)-3-pyridyl]benzothiophen-6-ol CAS Name: 3-[[3-methyl-4-(1-pyrrolidinylmethyl)phenyl]methyl]-2-[6-[2-(1-pyrrolidinyl)ethoxy]-3-pyridinyl]-1-benzothiophen-6-ol IUPAC Name: 3-[[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-[6-(2-pyrrolidin-1-ylethoxy)pyridin-3-yl]-1-benzothiophen-6-ol Traditional Name: 3-[3-methyl-4-(pyrrolidinomethyl)benzyl]-2-[6-(2-pyrrolidinoethoxy)-3-pyridyl]benzothiophen-6-ol Formula: C32H37N3O2S MolecularWeight: 527.72008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CC2=C(SC3=C2C=CC(=C3)O)C4=CN=C(C=C4)OCCN5CCCC5)CN6CCCC6

Isomeric SMILES

CC1=C(C=CC(=C1)CC2=C(SC3=C2C=CC(=C3)O)C4=CN=C(C=C4)OCCN5CCCC5)CN6CCCC6

InChI

InChI=1S/C32H37N3O2S/c1-23-18-24(6-7-26(23)22-35-14-4-5-15-35)19-29-28-10-9-27(36)20-30(28)38-32(29)25-8-11-31(33-21-25)37-17-16-34-12-2-3-13-34/h6-11,18,20-21,36H,2-5,12-17,19,22H2,1H3