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

Systemtic Name: 2-[[2-(2-imidazol-1-yl-1-phenyl-ethoxy)-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl]methylsulfonyl]-N-(1-oxidanylbutan-2-yl)benzamide Openeye Name: N-[1-(hydroxymethyl)propyl]-2-[[6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-oxo-tetralin-5-yl]methylsulfonyl]benzamide CAS Name: N-(1-hydroxybutan-2-yl)-2-[[2-[2-(1-imidazolyl)-1-phenylethoxy]-5-oxo-7,8-dihydro-6H-naphthalen-1-yl]methylsulfonyl]benzamide IUPAC Name: N-(1-hydroxybutan-2-yl)-2-[[2-(2-imidazol-1-yl-1-phenylethoxy)-5-oxo-7,8-dihydro-6H-naphthalen-1-yl]methylsulfonyl]benzamide Traditional Name: 2-[[6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-keto-tetralin-5-yl]methylsulfonyl]-N-(1-methylolpropyl)benzamide Formula: C33H35N3O6S MolecularWeight: 601.7125

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC(=O)C1=CC=CC=C1S(=O)(=O)CC2=C(C=CC3=C2CCCC3=O)OC(CN4C=CN=C4)C5=CC=CC=C5

Isomeric SMILES

CCC(CO)NC(=O)C1=CC=CC=C1S(=O)(=O)CC2=C(C=CC3=C2CCCC3=O)OC(CN4C=CN=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H35N3O6S/c1-2-24(20-37)35-33(39)27-11-6-7-14-32(27)43(40,41)21-28-25-12-8-13-29(38)26(25)15-16-30(28)42-31(19-36-18-17-34-22-36)23-9-4-3-5-10-23/h3-7,9-11,14-18,22,24,31,37H,2,8,12-13,19-21H2,1H3,(H,35,39)