N-(1-adamantylcarbamothioyl)-3,4-bis(chloranyl)benzamide

Systemtic Name: N-(1-adamantylcarbamothioyl)-3,4-bis(chloranyl)benzamide Openeye Name: N-(1-adamantylcarbamothioyl)-3,4-dichloro-benzamide CAS Name: N-[(1-adamantylamino)-sulfanylidenemethyl]-3,4-dichlorobenzamide IUPAC Name: N-(1-adamantylcarbamothioyl)-3,4-dichlorobenzamide Traditional Name: N-(1-adamantylthiocarbamoyl)-3,4-dichloro-benzamide Formula: C18H20Cl2N2OS MolecularWeight: 383.3352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20Cl2N2OS/c19-14-2-1-13(6-15(14)20)16(23)21-17(24)22-18-7-10-3-11(8-18)5-12(4-10)9-18/h1-2,6,10-12H,3-5,7-9H2,(H2,21,22,23,24)