N-(2-hydroxyethyl)-3-[[3-(2-imidazol-1-yl-1-phenyl-ethoxy)-8-oxidanylidene-6,7-dihydro-5H-naphthalen-1-yl]methylsulfonyl]benzamide

Systemtic Name: N-(2-hydroxyethyl)-3-[[3-(2-imidazol-1-yl-1-phenyl-ethoxy)-8-oxidanylidene-6,7-dihydro-5H-naphthalen-1-yl]methylsulfonyl]benzamide Openeye Name: N-(2-hydroxyethyl)-3-[[7-(2-imidazol-1-yl-1-phenyl-ethoxy)-4-oxo-tetralin-5-yl]methylsulfonyl]benzamide CAS Name: N-(2-hydroxyethyl)-3-[[3-[2-(1-imidazolyl)-1-phenylethoxy]-8-oxo-6,7-dihydro-5H-naphthalen-1-yl]methylsulfonyl]benzamide IUPAC Name: N-(2-hydroxyethyl)-3-[[3-(2-imidazol-1-yl-1-phenylethoxy)-8-oxo-6,7-dihydro-5H-naphthalen-1-yl]methylsulfonyl]benzamide Traditional Name: N-(2-hydroxyethyl)-3-[[7-(2-imidazol-1-yl-1-phenyl-ethoxy)-4-keto-tetralin-5-yl]methylsulfonyl]benzamide Formula: C31H31N3O6S MolecularWeight: 573.65934

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC(=CC(=C2C(=O)C1)CS(=O)(=O)C3=CC=CC(=C3)C(=O)NCCO)OC(CN4C=CN=C4)C5=CC=CC=C5

Isomeric SMILES

C1CC2=CC(=CC(=C2C(=O)C1)CS(=O)(=O)C3=CC=CC(=C3)C(=O)NCCO)OC(CN4C=CN=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H31N3O6S/c35-15-13-33-31(37)24-9-4-10-27(18-24)41(38,39)20-25-17-26(16-23-8-5-11-28(36)30(23)25)40-29(19-34-14-12-32-21-34)22-6-2-1-3-7-22/h1-4,6-7,9-10,12,14,16-18,21,29,35H,5,8,11,13,15,19-20H2,(H,33,37)