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

Systemtic Name: 5-methoxy-3-[[4-(2-pyrrolidin-1-ylcyclohexyl)oxyphenyl]methyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-6-ol Openeye Name: 5-methoxy-3-[[4-(2-pyrrolidin-1-ylcyclohexoxy)phenyl]methyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophen-6-ol CAS Name: 5-methoxy-3-[[4-[2-(1-pyrrolidinyl)cyclohexyl]oxyphenyl]methyl]-2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-benzothiophen-6-ol IUPAC Name: 5-methoxy-3-[[4-(2-pyrrolidin-1-ylcyclohexyl)oxyphenyl]methyl]-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-6-ol Traditional Name: 5-methoxy-3-[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=C2C(=C1)C(=C(S2)C3=CC=C(C=C3)OCCN4CCCC4)CC5=CC=C(C=C5)OC6CCCCC6N7CCCC7)O

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=C(S2)C3=CC=C(C=C3)OCCN4CCCC4)CC5=CC=C(C=C5)OC6CCCCC6N7CCCC7)O

InChI

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