N-(1-adamantyl)-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide

Systemtic Name: N-(1-adamantyl)-4-[methyl-(4-methylphenyl)sulfonyl-amino]benzamide Openeye Name: N-(1-adamantyl)-4-[methyl(p-tolylsulfonyl)amino]benzamide CAS Name: N-(1-adamantyl)-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide IUPAC Name: N-(1-adamantyl)-4-[methyl-(4-methylphenyl)sulfonylamino]benzamide Traditional Name: N-(1-adamantyl)-4-[methyl(tosyl)amino]benzamide Formula: C25H30N2O3S MolecularWeight: 438.5823

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)C(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H30N2O3S/c1-17-3-9-23(10-4-17)31(29,30)27(2)22-7-5-21(6-8-22)24(28)26-25-14-18-11-19(15-25)13-20(12-18)16-25/h3-10,18-20H,11-16H2,1-2H3,(H,26,28)