5-bromanyl-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[(6-oxidanyl-1,3-benzothiazol-2-yl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[(6-hydroxy-1,3-benzothiazol-2-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[(6-hydroxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-1-naphthamide Formula: C19H12BrN3O2S2 MolecularWeight: 458.35148

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2Br)C(=C1)C(=O)NC(=S)NC3=NC4=C(S3)C=C(C=C4)O

Isomeric SMILES

C1=CC2=C(C=CC=C2Br)C(=C1)C(=O)NC(=S)NC3=NC4=C(S3)C=C(C=C4)O

InChI

InChI=1S/C19H12BrN3O2S2/c20-14-6-2-3-11-12(14)4-1-5-13(11)17(25)22-18(26)23-19-21-15-8-7-10(24)9-16(15)27-19/h1-9,24H,(H2,21,22,23,25,26)