[2-(4-hydroxyphenyl)-6-methyl-1-benzothiophen-3-yl]-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methanone

Systemtic Name: [2-(4-hydroxyphenyl)-6-methyl-1-benzothiophen-3-yl]-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methanone Openeye Name: [2-(4-hydroxyphenyl)-6-methyl-benzothiophen-3-yl]-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methanone CAS Name: [2-(4-hydroxyphenyl)-6-methyl-1-benzothiophen-3-yl]-[3-methyl-4-(1-pyrrolidinylmethyl)phenyl]methanone IUPAC Name: [2-(4-hydroxyphenyl)-6-methyl-1-benzothiophen-3-yl]-[3-methyl-4-(pyrrolidin-1-ylmethyl)phenyl]methanone Traditional Name: [2-(4-hydroxyphenyl)-6-methyl-benzothiophen-3-yl]-[3-methyl-4-(pyrrolidinomethyl)phenyl]methanone Formula: C28H27NO2S MolecularWeight: 441.58448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)O)C(=O)C4=CC(=C(C=C4)CN5CCCC5)C

Isomeric SMILES

CC1=CC2=C(C=C1)C(=C(S2)C3=CC=C(C=C3)O)C(=O)C4=CC(=C(C=C4)CN5CCCC5)C

InChI

InChI=1S/C28H27NO2S/c1-18-5-12-24-25(15-18)32-28(20-8-10-23(30)11-9-20)26(24)27(31)21-6-7-22(19(2)16-21)17-29-13-3-4-14-29/h5-12,15-16,30H,3-4,13-14,17H2,1-2H3