N-[1-(1-adamantyl)ethylcarbamothioyl]-4-bromanyl-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: N-[1-(1-adamantyl)ethylcarbamothioyl]-4-bromanyl-3-methoxy-naphthalene-2-carboxamide Openeye Name: N-[1-(1-adamantyl)ethylcarbamothioyl]-4-bromo-3-methoxy-naphthalene-2-carboxamide CAS Name: N-[[1-(1-adamantyl)ethylamino]-sulfanylidenemethyl]-4-bromo-3-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[1-(1-adamantyl)ethylcarbamothioyl]-4-bromo-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[1-(1-adamantyl)ethylthiocarbamoyl]-4-bromo-3-methoxy-2-naphthamide Formula: C25H29BrN2O2S MolecularWeight: 501.47896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC(=O)C4=CC5=CC=CC=C5C(=C4OC)Br

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NC(=S)NC(=O)C4=CC5=CC=CC=C5C(=C4OC)Br

InChI

InChI=1S/C25H29BrN2O2S/c1-14(25-11-15-7-16(12-25)9-17(8-15)13-25)27-24(31)28-23(29)20-10-18-5-3-4-6-19(18)21(26)22(20)30-2/h3-6,10,14-17H,7-9,11-13H2,1-2H3,(H2,27,28,29,31)