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

Systemtic Name: [4-[5-(dibutylamino)pentoxy]-3,5-dimethyl-phenyl]-(2-ethyl-1-benzothiophen-3-yl)methanone Openeye Name: [4-[5-(dibutylamino)pentoxy]-3,5-dimethyl-phenyl]-(2-ethylbenzothiophen-3-yl)methanone CAS Name: [4-[5-(dibutylamino)pentoxy]-3,5-dimethylphenyl]-(2-ethyl-1-benzothiophen-3-yl)methanone IUPAC Name: [4-[5-(dibutylamino)pentoxy]-3,5-dimethylphenyl]-(2-ethyl-1-benzothiophen-3-yl)methanone Traditional Name: [4-[5-(dibutylamino)pentoxy]-3,5-dimethyl-phenyl]-(2-ethylbenzothiophen-3-yl)methanone Formula: C32H45NO2S MolecularWeight: 507.7702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCCCOC1=C(C=C(C=C1C)C(=O)C2=C(SC3=CC=CC=C32)CC)C

Isomeric SMILES

CCCCN(CCCC)CCCCCOC1=C(C=C(C=C1C)C(=O)C2=C(SC3=CC=CC=C32)CC)C

InChI

InChI=1S/C32H45NO2S/c1-6-9-18-33(19-10-7-2)20-14-11-15-21-35-32-24(4)22-26(23-25(32)5)31(34)30-27-16-12-13-17-29(27)36-28(30)8-3/h12-13,16-17,22-23H,6-11,14-15,18-21H2,1-5H3