4-bromanyl-3-methoxy-N-[(4-methyl-2-oxidanyl-phenyl)carbamothioyl]naphthalene-2-carboxamide

Systemtic Name: 4-bromanyl-3-methoxy-N-[(4-methyl-2-oxidanyl-phenyl)carbamothioyl]naphthalene-2-carboxamide Openeye Name: 4-bromo-N-[(2-hydroxy-4-methyl-phenyl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: 4-bromo-N-[(2-hydroxy-4-methylanilino)-sulfanylidenemethyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: 4-bromo-N-[(2-hydroxy-4-methylphenyl)carbamothioyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: 4-bromo-N-[(2-hydroxy-4-methyl-phenyl)thiocarbamoyl]-3-methoxy-2-naphthamide Formula: C20H17BrN2O3S MolecularWeight: 445.32958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br)O

InChI

InChI=1S/C20H17BrN2O3S/c1-11-7-8-15(16(24)9-11)22-20(27)23-19(25)14-10-12-5-3-4-6-13(12)17(21)18(14)26-2/h3-10,24H,1-2H3,(H2,22,23,25,27)