2-(1-adamantyl)-N-[(4-dimethylaminophenyl)carbamothioyl]ethanamide

Systemtic Name: 2-(1-adamantyl)-N-[(4-dimethylaminophenyl)carbamothioyl]ethanamide Openeye Name: 2-(1-adamantyl)-N-[(4-dimethylaminophenyl)carbamothioyl]acetamide CAS Name: 2-(1-adamantyl)-N-[[4-(dimethylamino)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-[(4-dimethylaminophenyl)carbamothioyl]acetamide Traditional Name: 2-(1-adamantyl)-N-[(4-dimethylaminophenyl)thiocarbamoyl]acetamide Formula: C21H29N3OS MolecularWeight: 371.53946

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)NC(=O)CC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H29N3OS/c1-24(2)18-5-3-17(4-6-18)22-20(26)23-19(25)13-21-10-14-7-15(11-21)9-16(8-14)12-21/h3-6,14-16H,7-13H2,1-2H3,(H2,22,23,25,26)