N-(1-adamantylcarbamothioyl)-4-phenyl-benzamide

Systemtic Name: N-(1-adamantylcarbamothioyl)-4-phenyl-benzamide Openeye Name: N-(1-adamantylcarbamothioyl)-4-phenyl-benzamide CAS Name: N-[(1-adamantylamino)-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-(1-adamantylcarbamothioyl)-4-phenylbenzamide Traditional Name: N-(1-adamantylthiocarbamoyl)-4-phenyl-benzamide Formula: C24H26N2OS MolecularWeight: 390.54104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H26N2OS/c27-22(21-8-6-20(7-9-21)19-4-2-1-3-5-19)25-23(28)26-24-13-16-10-17(14-24)12-18(11-16)15-24/h1-9,16-18H,10-15H2,(H2,25,26,27,28)