2-(1-adamantyl)-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)ethanamide

Systemtic Name: 2-(1-adamantyl)-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)ethanamide Openeye Name: 2-(1-adamantyl)-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)acetamide CAS Name: 2-(1-adamantyl)-N-[(1,2-dihydroacenaphthylen-5-ylamino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1-adamantyl)-N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)acetamide Traditional Name: N-(acenaphthen-5-ylthiocarbamoyl)-2-(1-adamantyl)acetamide Formula: C25H28N2OS MolecularWeight: 404.56762

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC3=C(C=CC1=C23)NC(=S)NC(=O)CC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

C1CC2=CC=CC3=C(C=CC1=C23)NC(=S)NC(=O)CC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C25H28N2OS/c28-22(14-25-11-15-8-16(12-25)10-17(9-15)13-25)27-24(29)26-21-7-6-19-5-4-18-2-1-3-20(21)23(18)19/h1-3,6-7,15-17H,4-5,8-14H2,(H2,26,27,28,29)