N-[1-(1-adamantyl)ethylcarbamothioyl]-5-(2,4-dichlorophenyl)furan-2-carboxamide

Systemtic Name: N-[1-(1-adamantyl)ethylcarbamothioyl]-5-(2,4-dichlorophenyl)furan-2-carboxamide Openeye Name: N-[1-(1-adamantyl)ethylcarbamothioyl]-5-(2,4-dichlorophenyl)furan-2-carboxamide CAS Name: N-[[1-(1-adamantyl)ethylamino]-sulfanylidenemethyl]-5-(2,4-dichlorophenyl)-2-furancarboxamide IUPAC Name: N-[1-(1-adamantyl)ethylcarbamothioyl]-5-(2,4-dichlorophenyl)furan-2-carboxamide Traditional Name: N-[1-(1-adamantyl)ethylthiocarbamoyl]-5-(2,4-dichlorophenyl)-2-furamide Formula: C24H26Cl2N2O2S MolecularWeight: 477.44644

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC(=O)C4=CC=C(O4)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC(=O)C4=CC=C(O4)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C24H26Cl2N2O2S/c1-13(24-10-14-6-15(11-24)8-16(7-14)12-24)27-23(31)28-22(29)21-5-4-20(30-21)18-3-2-17(25)9-19(18)26/h2-5,9,13-16H,6-8,10-12H2,1H3,(H2,27,28,29,31)