5-bromanyl-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[4-(1-pyrrolidinyl)anilino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[(4-pyrrolidin-1-ylphenyl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[(4-pyrrolidinophenyl)thiocarbamoyl]-1-naphthamide Formula: C22H20BrN3OS MolecularWeight: 454.3827

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H20BrN3OS/c23-20-8-4-5-17-18(20)6-3-7-19(17)21(27)25-22(28)24-15-9-11-16(12-10-15)26-13-1-2-14-26/h3-12H,1-2,13-14H2,(H2,24,25,27,28)