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

Systemtic Name: 4-bromanyl-N-[(3-ethanoylphenyl)carbamothioyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: N-[(3-acetylphenyl)carbamothioyl]-4-bromo-3-methoxy-naphthalene-2-carboxamide CAS Name: N-[(3-acetylanilino)-sulfanylidenemethyl]-4-bromo-3-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[(3-acetylphenyl)carbamothioyl]-4-bromo-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[(3-acetylphenyl)thiocarbamoyl]-4-bromo-3-methoxy-2-naphthamide Formula: C21H17BrN2O3S MolecularWeight: 457.34028

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H17BrN2O3S/c1-12(25)13-7-5-8-15(10-13)23-21(28)24-20(26)17-11-14-6-3-4-9-16(14)18(22)19(17)27-2/h3-11H,1-2H3,(H2,23,24,26,28)