N-(3,4-dihydro-1H-isoquinolin-2-ylcarbothioyl)adamantane-1-carboxamide

Systemtic Name: N-(3,4-dihydro-1H-isoquinolin-2-ylcarbothioyl)adamantane-1-carboxamide Openeye Name: N-(3,4-dihydro-1H-isoquinoline-2-carbothioyl)adamantane-1-carboxamide CAS Name: N-[3,4-dihydro-1H-isoquinolin-2-yl(sulfanylidene)methyl]-1-adamantanecarboxamide IUPAC Name: N-(3,4-dihydro-1H-isoquinoline-2-carbothioyl)adamantane-1-carboxamide Traditional Name: N-(3,4-dihydro-1H-isoquinoline-2-carbothioyl)adamantane-1-carboxamide Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=S)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=S)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H26N2OS/c24-19(21-10-14-7-15(11-21)9-16(8-14)12-21)22-20(25)23-6-5-17-3-1-2-4-18(17)13-23/h1-4,14-16H,5-13H2,(H,22,24,25)