2-(1-adamantyl)-N-[(2-cyanophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(2-cyanophenyl)carbamothioyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[(2-cyanophenyl)carbamothioyl]acetamide CAS Name: 2-(1-adamantyl)-N-[(2-cyanoanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(2-cyanophenyl)carbamothioyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[(2-cyanophenyl)thiocarbamoyl]acetamide Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NC(=S)NC4=CC=CC=C4C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NC(=S)NC4=CC=CC=C4C#N

InChI

InChI=1S/C20H23N3OS/c21-12-16-3-1-2-4-17(16)22-19(25)23-18(24)11-20-8-13-5-14(9-20)7-15(6-13)10-20/h1-4,13-15H,5-11H2,(H2,22,23,24,25)