5-bromanyl-N-[(3-chloranyl-4-morpholin-4-yl-phenyl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[(3-chloranyl-4-morpholin-4-yl-phenyl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[(3-chloro-4-morpholino-phenyl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[3-chloro-4-(4-morpholinyl)anilino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[(3-chloro-4-morpholin-4-ylphenyl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[(3-chloro-4-morpholino-phenyl)thiocarbamoyl]-1-naphthamide Formula: C22H19BrClN3O2S MolecularWeight: 504.82716

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br)Cl

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br)Cl

InChI

InChI=1S/C22H19BrClN3O2S/c23-18-6-2-3-15-16(18)4-1-5-17(15)21(28)26-22(30)25-14-7-8-20(19(24)13-14)27-9-11-29-12-10-27/h1-8,13H,9-12H2,(H2,25,26,28,30)