N-(1-adamantylcarbamothioyl)-5-(3-chlorophenyl)furan-2-carboxamide

Systemtic Name: N-(1-adamantylcarbamothioyl)-5-(3-chlorophenyl)furan-2-carboxamide Openeye Name: N-(1-adamantylcarbamothioyl)-5-(3-chlorophenyl)furan-2-carboxamide CAS Name: N-[(1-adamantylamino)-sulfanylidenemethyl]-5-(3-chlorophenyl)-2-furancarboxamide IUPAC Name: N-(1-adamantylcarbamothioyl)-5-(3-chlorophenyl)furan-2-carboxamide Traditional Name: N-(1-adamantylthiocarbamoyl)-5-(3-chlorophenyl)-2-furamide Formula: C22H23ClN2O2S MolecularWeight: 414.94822

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=S)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC(=S)NC(=O)C4=CC=C(O4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C22H23ClN2O2S/c23-17-3-1-2-16(9-17)18-4-5-19(27-18)20(26)24-21(28)25-22-10-13-6-14(11-22)8-15(7-13)12-22/h1-5,9,13-15H,6-8,10-12H2,(H2,24,25,26,28)