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

Systemtic Name: 4-bromanyl-N-[(3-chloranyl-4-methoxy-phenyl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: 4-bromo-N-[(3-chloro-4-methoxy-phenyl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide CAS Name: 4-bromo-N-[(3-chloro-4-methoxyanilino)-sulfanylidenemethyl]-3-methoxy-2-naphthalenecarboxamide IUPAC Name: 4-bromo-N-[(3-chloro-4-methoxyphenyl)carbamothioyl]-3-methoxynaphthalene-2-carboxamide Traditional Name: 4-bromo-N-[(3-chloro-4-methoxy-phenyl)thiocarbamoyl]-3-methoxy-2-naphthamide Formula: C20H16BrClN2O3S MolecularWeight: 479.77464

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br)Cl

InChI

InChI=1S/C20H16BrClN2O3S/c1-26-16-8-7-12(10-15(16)22)23-20(28)24-19(25)14-9-11-5-3-4-6-13(11)17(21)18(14)27-2/h3-10H,1-2H3,(H2,23,24,25,28)