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

Systemtic Name: N-[3-[2-[(2-methylphenyl)amino]-1,3-thiazol-4-yl]phenyl]adamantane-1-carboxamide Openeye Name: N-[3-[2-(2-methylanilino)thiazol-4-yl]phenyl]adamantane-1-carboxamide CAS Name: N-[3-[2-(2-methylanilino)-4-thiazolyl]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[3-[2-(2-methylanilino)-1,3-thiazol-4-yl]phenyl]adamantane-1-carboxamide Traditional Name: N-[3-[2-(o-toluidino)thiazol-4-yl]phenyl]adamantane-1-carboxamide Formula: C27H29N3OS MolecularWeight: 443.60366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=CS2)C3=CC(=CC=C3)NC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C27H29N3OS/c1-17-5-2-3-8-23(17)29-26-30-24(16-32-26)21-6-4-7-22(12-21)28-25(31)27-13-18-9-19(14-27)11-20(10-18)15-27/h2-8,12,16,18-20H,9-11,13-15H2,1H3,(H,28,31)(H,29,30)