(3,4-dimethoxyphenyl)-[6-phenylmethoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone

Systemtic Name: (3,4-dimethoxyphenyl)-[6-phenylmethoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone Openeye Name: [6-benzyloxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzothiophen-3-yl]-(3,4-dimethoxyphenyl)methanone CAS Name: (3,4-dimethoxyphenyl)-[6-phenylmethoxy-2-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]-1-benzothiophen-3-yl]methanone IUPAC Name: (3,4-dimethoxyphenyl)-[6-phenylmethoxy-2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1-benzothiophen-3-yl]methanone Traditional Name: [6-benzoxy-2-[4-(2-pyrrolidinoethoxy)phenyl]benzothiophen-3-yl]-(3,4-dimethoxyphenyl)methanone Formula: C36H35NO5S MolecularWeight: 593.7318

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)C2=C(SC3=C2C=CC(=C3)OCC4=CC=CC=C4)C5=CC=C(C=C5)OCCN6CCCC6)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)C2=C(SC3=C2C=CC(=C3)OCC4=CC=CC=C4)C5=CC=C(C=C5)OCCN6CCCC6)OC

InChI

InChI=1S/C36H35NO5S/c1-39-31-17-12-27(22-32(31)40-2)35(38)34-30-16-15-29(42-24-25-8-4-3-5-9-25)23-33(30)43-36(34)26-10-13-28(14-11-26)41-21-20-37-18-6-7-19-37/h3-5,8-17,22-23H,6-7,18-21,24H2,1-2H3