N-(1-adamantylcarbamothioyl)-4-hexoxy-benzamide

Systemtic Name: N-(1-adamantylcarbamothioyl)-4-hexoxy-benzamide Openeye Name: N-(1-adamantylcarbamothioyl)-4-hexoxy-benzamide CAS Name: N-[(1-adamantylamino)-sulfanylidenemethyl]-4-hexoxybenzamide IUPAC Name: N-(1-adamantylcarbamothioyl)-4-hexoxybenzamide Traditional Name: N-(1-adamantylthiocarbamoyl)-4-hexoxy-benzamide Formula: C24H34N2O2S MolecularWeight: 414.60396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C24H34N2O2S/c1-2-3-4-5-10-28-21-8-6-20(7-9-21)22(27)25-23(29)26-24-14-17-11-18(15-24)13-19(12-17)16-24/h6-9,17-19H,2-5,10-16H2,1H3,(H2,25,26,27,29)