5-bromanyl-N-[(6-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[(6-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[(6-morpholino-1,3-benzothiazol-2-yl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[[6-(4-morpholinyl)-1,3-benzothiazol-2-yl]amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[(6-morpholin-4-yl-1,3-benzothiazol-2-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[(6-morpholino-1,3-benzothiazol-2-yl)thiocarbamoyl]-1-naphthamide Formula: C23H19BrN4O2S2 MolecularWeight: 527.45656

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Br

Isomeric SMILES

C1COCCN1C2=CC3=C(C=C2)N=C(S3)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Br

InChI

InChI=1S/C23H19BrN4O2S2/c24-18-6-2-3-15-16(18)4-1-5-17(15)21(29)26-22(31)27-23-25-19-8-7-14(13-20(19)32-23)28-9-11-30-12-10-28/h1-8,13H,9-12H2,(H2,25,26,27,29,31)