5-bromanyl-N-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[(2-keto-1,3-dihydrobenzimidazol-5-yl)thiocarbamoyl]-1-naphthamide Formula: C19H13BrN4O2S MolecularWeight: 441.30112

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2Br)C(=C1)C(=O)NC(=S)NC3=CC4=C(C=C3)NC(=O)N4

Isomeric SMILES

C1=CC2=C(C=CC=C2Br)C(=C1)C(=O)NC(=S)NC3=CC4=C(C=C3)NC(=O)N4

InChI

InChI=1S/C19H13BrN4O2S/c20-14-6-2-3-11-12(14)4-1-5-13(11)17(25)24-19(27)21-10-7-8-15-16(9-10)23-18(26)22-15/h1-9H,(H2,22,23,26)(H2,21,24,25,27)