N-(1-adamantylcarbamothioyl)-2,4-dimethyl-benzamide

Systemtic Name: N-(1-adamantylcarbamothioyl)-2,4-dimethyl-benzamide Openeye Name: N-(1-adamantylcarbamothioyl)-2,4-dimethyl-benzamide CAS Name: N-[(1-adamantylamino)-sulfanylidenemethyl]-2,4-dimethylbenzamide IUPAC Name: N-(1-adamantylcarbamothioyl)-2,4-dimethylbenzamide Traditional Name: N-(1-adamantylthiocarbamoyl)-2,4-dimethyl-benzamide Formula: C20H26N2OS MolecularWeight: 342.49824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3)C

InChI

InChI=1S/C20H26N2OS/c1-12-3-4-17(13(2)5-12)18(23)21-19(24)22-20-9-14-6-15(10-20)8-16(7-14)11-20/h3-5,14-16H,6-11H2,1-2H3,(H2,21,22,23,24)