N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]adamantane-1-carboxamide

Systemtic Name: N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]adamantane-1-carboxamide Openeye Name: N-[(4-phenylthiazol-2-yl)carbamothioyl]adamantane-1-carboxamide CAS Name: N-[[(4-phenyl-2-thiazolyl)amino]-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]adamantane-1-carboxamide Traditional Name: N-[(4-phenylthiazol-2-yl)thiocarbamoyl]adamantane-1-carboxamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=NC(=CS4)C5=CC=CC=C5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NC(=S)NC4=NC(=CS4)C5=CC=CC=C5

InChI

InChI=1S/C21H23N3OS2/c25-18(21-9-13-6-14(10-21)8-15(7-13)11-21)23-19(26)24-20-22-17(12-27-20)16-4-2-1-3-5-16/h1-5,12-15H,6-11H2,(H2,22,23,24,25,26)