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

Systemtic Name: 3-[[3-methoxy-4-(2-pyrrolidin-1-ylcyclohexyl)oxy-phenyl]methyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-6-ol Openeye Name: 3-[[3-methoxy-4-(2-pyrrolidin-1-ylcyclohexoxy)phenyl]methyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophen-6-ol CAS Name: 3-[[3-methoxy-4-[2-(1-pyrrolidinyl)cyclohexyl]oxyphenyl]methyl]-2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-benzothiophen-6-ol IUPAC Name: 3-[[3-methoxy-4-(2-pyrrolidin-1-ylcyclohexyl)oxyphenyl]methyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-6-ol Traditional Name: 3-[3-methoxy-4-(2-pyrrolidinocyclohexoxy)benzyl]-2-[4-(2-pyrrolidinoethoxy)phenyl]benzothiophen-6-ol Formula: C38H46N2O4S MolecularWeight: 626.84784

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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)OCCN5CCCC5)OC6CCCCC6N7CCCC7

Isomeric SMILES

COC1=C(C=CC(=C1)CC2=C(SC3=C2C=CC(=C3)O)C4=CC=C(C=C4)OCCN5CCCC5)OC6CCCCC6N7CCCC7

InChI

InChI=1S/C38H46N2O4S/c1-42-36-25-27(10-17-35(36)44-34-9-3-2-8-33(34)40-20-6-7-21-40)24-32-31-16-13-29(41)26-37(31)45-38(32)28-11-14-30(15-12-28)43-23-22-39-18-4-5-19-39/h10-17,25-26,33-34,41H,2-9,18-24H2,1H3