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

Systemtic Name: 3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-[4-(2-pyrazol-1-ylethoxy)phenyl]-1-benzothiophen-6-ol Openeye Name: 3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-[4-(2-pyrazol-1-ylethoxy)phenyl]benzothiophen-6-ol CAS Name: 3-[[3-methoxy-4-(1-pyrrolidinylmethyl)phenyl]methyl]-2-[4-[2-(1-pyrazolyl)ethoxy]phenyl]-1-benzothiophen-6-ol IUPAC Name: 3-[[3-methoxy-4-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-[4-(2-pyrazol-1-ylethoxy)phenyl]-1-benzothiophen-6-ol Traditional Name: 3-[3-methoxy-4-(pyrrolidinomethyl)benzyl]-2-[4-(2-pyrazol-1-ylethoxy)phenyl]benzothiophen-6-ol Formula: C32H33N3O3S MolecularWeight: 539.68772

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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)OCCN5C=CC=N5)CN6CCCC6

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)OCCN5C=CC=N5)CN6CCCC6

InChI

InChI=1S/C32H33N3O3S/c1-37-30-20-23(5-6-25(30)22-34-14-2-3-15-34)19-29-28-12-9-26(36)21-31(28)39-32(29)24-7-10-27(11-8-24)38-18-17-35-16-4-13-33-35/h4-13,16,20-21,36H,2-3,14-15,17-19,22H2,1H3