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

Systemtic Name: N-(2-adamantylcarbamothioyl)-4-methyl-benzamide Openeye Name: N-(2-adamantylcarbamothioyl)-4-methyl-benzamide CAS Name: N-[(2-adamantylamino)-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: N-(2-adamantylcarbamothioyl)-4-methylbenzamide Traditional Name: N-(2-adamantylthiocarbamoyl)-4-methyl-benzamide Formula: C19H24N2OS MolecularWeight: 328.47166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NC2C3CC4CC(C3)CC2C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NC2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C19H24N2OS/c1-11-2-4-14(5-3-11)18(22)21-19(23)20-17-15-7-12-6-13(9-15)10-16(17)8-12/h2-5,12-13,15-17H,6-10H2,1H3,(H2,20,21,22,23)