5-(6-acetamido-2-methyl-pyridin-3-yl)-N-(1-adamantylmethyl)-2-chloranyl-benzamide

Systemtic Name: 5-(6-acetamido-2-methyl-pyridin-3-yl)-N-(1-adamantylmethyl)-2-chloranyl-benzamide Openeye Name: 5-(6-acetamido-2-methyl-3-pyridyl)-N-(1-adamantylmethyl)-2-chloro-benzamide CAS Name: 5-(6-acetamido-2-methyl-3-pyridinyl)-N-(1-adamantylmethyl)-2-chlorobenzamide IUPAC Name: 5-(6-acetamido-2-methylpyridin-3-yl)-N-(1-adamantylmethyl)-2-chlorobenzamide Traditional Name: 5-(6-acetamido-2-methyl-3-pyridyl)-N-(1-adamantylmethyl)-2-chloro-benzamide Formula: C26H30ClN3O2 MolecularWeight: 451.9883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)NC(=O)C)C2=CC(=C(C=C2)Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=C(C=CC(=N1)NC(=O)C)C2=CC(=C(C=C2)Cl)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C26H30ClN3O2/c1-15-21(4-6-24(29-15)30-16(2)31)20-3-5-23(27)22(10-20)25(32)28-14-26-11-17-7-18(12-26)9-19(8-17)13-26/h3-6,10,17-19H,7-9,11-14H2,1-2H3,(H,28,32)(H,29,30,31)