(2-cyclohexyl-6-oxidanyl-1-benzothiophen-3-yl)-[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanone

Systemtic Name: (2-cyclohexyl-6-oxidanyl-1-benzothiophen-3-yl)-[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanone Openeye Name: (2-cyclohexyl-6-hydroxy-benzothiophen-3-yl)-[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanone CAS Name: (2-cyclohexyl-6-hydroxy-1-benzothiophen-3-yl)-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]methanone IUPAC Name: (2-cyclohexyl-6-hydroxy-1-benzothiophen-3-yl)-[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanone Traditional Name: (2-cyclohexyl-6-hydroxy-benzothiophen-3-yl)-[4-(2-pyrrolidinoethoxy)phenyl]methanone Formula: C27H31NO3S MolecularWeight: 449.60494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)OCCN5CCCC5

Isomeric SMILES

C1CCC(CC1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)OCCN5CCCC5

InChI

InChI=1S/C27H31NO3S/c29-21-10-13-23-24(18-21)32-27(20-6-2-1-3-7-20)25(23)26(30)19-8-11-22(12-9-19)31-17-16-28-14-4-5-15-28/h8-13,18,20,29H,1-7,14-17H2