N-[4-[2-[(3-methoxyphenyl)amino]-1,3-thiazol-4-yl]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[2-[(3-methoxyphenyl)amino]-1,3-thiazol-4-yl]phenyl]adamantane-1-carboxamide Openeye Name: N-[4-[2-(3-methoxyanilino)thiazol-4-yl]phenyl]adamantane-1-carboxamide CAS Name: N-[4-[2-(3-methoxyanilino)-4-thiazolyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[2-(3-methoxyanilino)-1,3-thiazol-4-yl]phenyl]adamantane-1-carboxamide Traditional Name: N-[4-[2-(m-anisidino)thiazol-4-yl]phenyl]adamantane-1-carboxamide Formula: C27H29N3O2S MolecularWeight: 459.60306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC(=CS2)C3=CC=C(C=C3)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H29N3O2S/c1-32-23-4-2-3-22(12-23)29-26-30-24(16-33-26)20-5-7-21(8-6-20)28-25(31)27-13-17-9-18(14-27)11-19(10-17)15-27/h2-8,12,16-19H,9-11,13-15H2,1H3,(H,28,31)(H,29,30)