2-(1-adamantyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyridine-4-carboxamide

Systemtic Name: 2-(1-adamantyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyridine-4-carboxamide Openeye Name: 2-(1-adamantyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyridine-4-carboxamide CAS Name: 2-(1-adamantyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-pyridinecarboxamide IUPAC Name: 2-(1-adamantyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)pyridine-4-carboxamide Traditional Name: 2-(1-adamantyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)isonicotinamide Formula: C23H27N3OS MolecularWeight: 393.54498

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC(=NC=C3)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CCC2=C(C1)N=C(S2)NC(=O)C3=CC(=NC=C3)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C23H27N3OS/c27-21(26-22-25-18-3-1-2-4-19(18)28-22)17-5-6-24-20(10-17)23-11-14-7-15(12-23)9-16(8-14)13-23/h5-6,10,14-16H,1-4,7-9,11-13H2,(H,25,26,27)