3,3-dibutyl-7-(dimethylamino)-1-oxidanylidene-5-phenyl-4,5-dihydro-2H-1$l^{4}-benzothiepin-4-ol

Systemtic Name: 3,3-dibutyl-7-(dimethylamino)-1-oxidanylidene-5-phenyl-4,5-dihydro-2H-1$l^{4}-benzothiepin-4-ol Openeye Name: 3,3-dibutyl-7-(dimethylamino)-1-oxo-5-phenyl-4,5-dihydro-2H-1$l^{4}-benzothiepin-4-ol CAS Name: 3,3-dibutyl-7-(dimethylamino)-1-oxo-5-phenyl-4,5-dihydro-2H-1$l^{4}-benzothiepin-4-ol IUPAC Name: 3,3-dibutyl-7-(dimethylamino)-1-oxo-5-phenyl-4,5-dihydro-2H-1$l^{4}-benzothiepin-4-ol Traditional Name: 3,3-dibutyl-7-(dimethylamino)-1-keto-5-phenyl-4,5-dihydro-2H-1$l^{4}-benzothiepin-4-ol Formula: C26H37NO2S MolecularWeight: 427.64248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CS(=O)C2=C(C=C(C=C2)N(C)C)C(C1O)C3=CC=CC=C3)CCCC

Isomeric SMILES

CCCCC1(CS(=O)C2=C(C=C(C=C2)N(C)C)C(C1O)C3=CC=CC=C3)CCCC

InChI

InChI=1S/C26H37NO2S/c1-5-7-16-26(17-8-6-2)19-30(29)23-15-14-21(27(3)4)18-22(23)24(25(26)28)20-12-10-9-11-13-20/h9-15,18,24-25,28H,5-8,16-17,19H2,1-4H3