N-(1-adamantylcarbamothioyl)-4-(2-methylpropoxy)benzamide

Systemtic Name: N-(1-adamantylcarbamothioyl)-4-(2-methylpropoxy)benzamide Openeye Name: N-(1-adamantylcarbamothioyl)-4-isobutoxy-benzamide CAS Name: N-[(1-adamantylamino)-sulfanylidenemethyl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-(1-adamantylcarbamothioyl)-4-(2-methylpropoxy)benzamide Traditional Name: N-(1-adamantylthiocarbamoyl)-4-isobutoxy-benzamide Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)NC(=S)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H30N2O2S/c1-14(2)13-26-19-5-3-18(4-6-19)20(25)23-21(27)24-22-10-15-7-16(11-22)9-17(8-15)12-22/h3-6,14-17H,7-13H2,1-2H3,(H2,23,24,25,27)