4-(diethylsulfamoyl)-N-[4-[3-(4-methylphenyl)-1-adamantyl]-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-(diethylsulfamoyl)-N-[4-[3-(4-methylphenyl)-1-adamantyl]-1,3-thiazol-2-yl]benzamide Openeye Name: 4-(diethylsulfamoyl)-N-[4-[3-(p-tolyl)-1-adamantyl]thiazol-2-yl]benzamide CAS Name: 4-(diethylsulfamoyl)-N-[4-[3-(4-methylphenyl)-1-adamantyl]-2-thiazolyl]benzamide IUPAC Name: 4-(diethylsulfamoyl)-N-[4-[3-(4-methylphenyl)-1-adamantyl]-1,3-thiazol-2-yl]benzamide Traditional Name: 4-(diethylsulfamoyl)-N-[4-[3-(p-tolyl)-1-adamantyl]thiazol-2-yl]benzamide Formula: C31H37N3O3S2 MolecularWeight: 563.77378

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)(C4)C6=CC=C(C=C6)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C34CC5CC(C3)CC(C5)(C4)C6=CC=C(C=C6)C

InChI

InChI=1S/C31H37N3O3S2/c1-4-34(5-2)39(36,37)26-12-8-24(9-13-26)28(35)33-29-32-27(19-38-29)31-17-22-14-23(18-31)16-30(15-22,20-31)25-10-6-21(3)7-11-25/h6-13,19,22-23H,4-5,14-18,20H2,1-3H3,(H,32,33,35)