2-(1-adamantyl)-N-[(3-bromophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(3-bromophenyl)carbamothioyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[(3-bromophenyl)carbamothioyl]acetamide CAS Name: 2-(1-adamantyl)-N-[(3-bromoanilino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(3-bromophenyl)carbamothioyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[(3-bromophenyl)thiocarbamoyl]acetamide Formula: C19H23BrN2OS MolecularWeight: 407.36772

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CC(=O)NC(=S)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CC(=O)NC(=S)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C19H23BrN2OS/c20-15-2-1-3-16(7-15)21-18(24)22-17(23)11-19-8-12-4-13(9-19)6-14(5-12)10-19/h1-3,7,12-14H,4-6,8-11H2,(H2,21,22,23,24)