[4-(4-bromanylbutoxy)-3,5-dimethyl-phenyl]-(2-ethyl-1-benzothiophen-3-yl)methanone

Systemtic Name: [4-(4-bromanylbutoxy)-3,5-dimethyl-phenyl]-(2-ethyl-1-benzothiophen-3-yl)methanone Openeye Name: [4-(4-bromobutoxy)-3,5-dimethyl-phenyl]-(2-ethylbenzothiophen-3-yl)methanone CAS Name: [4-(4-bromobutoxy)-3,5-dimethylphenyl]-(2-ethyl-1-benzothiophen-3-yl)methanone IUPAC Name: [4-(4-bromobutoxy)-3,5-dimethylphenyl]-(2-ethyl-1-benzothiophen-3-yl)methanone Traditional Name: [4-(4-bromobutoxy)-3,5-dimethyl-phenyl]-(2-ethylbenzothiophen-3-yl)methanone Formula: C23H25BrO2S MolecularWeight: 445.4124

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2S1)C(=O)C3=CC(=C(C(=C3)C)OCCCCBr)C

Isomeric SMILES

CCC1=C(C2=CC=CC=C2S1)C(=O)C3=CC(=C(C(=C3)C)OCCCCBr)C

InChI

InChI=1S/C23H25BrO2S/c1-4-19-21(18-9-5-6-10-20(18)27-19)22(25)17-13-15(2)23(16(3)14-17)26-12-8-7-11-24/h5-6,9-10,13-14H,4,7-8,11-12H2,1-3H3