N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)adamantane-1-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)adamantane-1-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)adamantane-1-carboxamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-sulfanylidenemethyl]-1-adamantanecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)adamantane-1-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylthiocarbamoyl)adamantane-1-carboxamide Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=S)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=S)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H24N2O3S/c23-18(20-9-12-5-13(10-20)7-14(6-12)11-20)22-19(26)21-15-1-2-16-17(8-15)25-4-3-24-16/h1-2,8,12-14H,3-7,9-11H2,(H2,21,22,23,26)