N-[3-[(6-methylpyridin-2-yl)carbonylamino]-1-adamantyl]-1,3-benzothiazole-2-carboxamide

Systemtic Name: N-[3-[(6-methylpyridin-2-yl)carbonylamino]-1-adamantyl]-1,3-benzothiazole-2-carboxamide Openeye Name: N-[3-[(6-methylpyridine-2-carbonyl)amino]-1-adamantyl]-1,3-benzothiazole-2-carboxamide CAS Name: N-[3-[[(6-methyl-2-pyridinyl)-oxomethyl]amino]-1-adamantyl]-1,3-benzothiazole-2-carboxamide IUPAC Name: N-[3-[(6-methylpyridine-2-carbonyl)amino]-1-adamantyl]-1,3-benzothiazole-2-carboxamide Traditional Name: N-[3-[(6-methylpicolinoyl)amino]-1-adamantyl]-1,3-benzothiazole-2-carboxamide Formula: C25H26N4O2S MolecularWeight: 446.56454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C(=O)NC23CC4CC(C2)CC(C4)(C3)NC(=O)C5=NC6=CC=CC=C6S5

Isomeric SMILES

CC1=CC=CC(=N1)C(=O)NC23CC4CC(C2)CC(C4)(C3)NC(=O)C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C25H26N4O2S/c1-15-5-4-7-19(26-15)21(30)28-24-10-16-9-17(11-24)13-25(12-16,14-24)29-22(31)23-27-18-6-2-3-8-20(18)32-23/h2-8,16-17H,9-14H2,1H3,(H,28,30)(H,29,31)