5-bromanyl-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[2-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[(2-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[(2-pyrrolidinophenyl)thiocarbamoyl]-1-naphthamide Formula: C22H20BrN3OS MolecularWeight: 454.3827

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br

Isomeric SMILES

C1CCN(C1)C2=CC=CC=C2NC(=S)NC(=O)C3=CC=CC4=C3C=CC=C4Br

InChI

InChI=1S/C22H20BrN3OS/c23-18-10-6-7-15-16(18)8-5-9-17(15)21(27)25-22(28)24-19-11-1-2-12-20(19)26-13-3-4-14-26/h1-2,5-12H,3-4,13-14H2,(H2,24,25,27,28)