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

Systemtic Name: N-(1-adamantylcarbamothioyl)-4-propoxy-benzamide Openeye Name: N-(1-adamantylcarbamothioyl)-4-propoxy-benzamide CAS Name: N-[(1-adamantylamino)-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-(1-adamantylcarbamothioyl)-4-propoxybenzamide Traditional Name: N-(1-adamantylthiocarbamoyl)-4-propoxy-benzamide Formula: C21H28N2O2S MolecularWeight: 372.52422

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H28N2O2S/c1-2-7-25-18-5-3-17(4-6-18)19(24)22-20(26)23-21-11-14-8-15(12-21)10-16(9-14)13-21/h3-6,14-16H,2,7-13H2,1H3,(H2,22,23,24,26)