N-(2-adamantylcarbamothioyl)-4-phenyl-benzamide

Systemtic Name: N-(2-adamantylcarbamothioyl)-4-phenyl-benzamide Openeye Name: N-(2-adamantylcarbamothioyl)-4-phenyl-benzamide CAS Name: N-[(2-adamantylamino)-sulfanylidenemethyl]-4-phenylbenzamide IUPAC Name: N-(2-adamantylcarbamothioyl)-4-phenylbenzamide Traditional Name: N-(2-adamantylthiocarbamoyl)-4-phenyl-benzamide Formula: C24H26N2OS MolecularWeight: 390.54104

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)C3NC(=S)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)C3NC(=S)NC(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

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