4-bromanyl-3-methoxy-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]naphthalene-2-carboxamide

Systemtic Name: 4-bromanyl-3-methoxy-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]naphthalene-2-carboxamide Openeye Name: 4-bromo-3-methoxy-N-[(4-phenylthiazol-2-yl)carbamothioyl]naphthalene-2-carboxamide CAS Name: 4-bromo-3-methoxy-N-[[(4-phenyl-2-thiazolyl)amino]-sulfanylidenemethyl]-2-naphthalenecarboxamide IUPAC Name: 4-bromo-3-methoxy-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]naphthalene-2-carboxamide Traditional Name: 4-bromo-3-methoxy-N-[(4-phenylthiazol-2-yl)thiocarbamoyl]-2-naphthamide Formula: C22H16BrN3O2S2 MolecularWeight: 498.41534

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=NC(=CS3)C4=CC=CC=C4)Br

Isomeric SMILES

COC1=C(C2=CC=CC=C2C=C1C(=O)NC(=S)NC3=NC(=CS3)C4=CC=CC=C4)Br

InChI

InChI=1S/C22H16BrN3O2S2/c1-28-19-16(11-14-9-5-6-10-15(14)18(19)23)20(27)25-21(29)26-22-24-17(12-30-22)13-7-3-2-4-8-13/h2-12H,1H3,(H2,24,25,26,27,29)