5-bromanyl-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]naphthalene-1-carboxamide

Systemtic Name: 5-bromanyl-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Openeye Name: 5-bromo-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]naphthalene-1-carboxamide CAS Name: 5-bromo-N-[[(2-phenyl-5-benzotriazolyl)amino]-sulfanylidenemethyl]-1-naphthalenecarboxamide IUPAC Name: 5-bromo-N-[(2-phenylbenzotriazol-5-yl)carbamothioyl]naphthalene-1-carboxamide Traditional Name: 5-bromo-N-[(2-phenylbenzotriazol-5-yl)thiocarbamoyl]-1-naphthamide Formula: C24H16BrN5OS MolecularWeight: 502.38574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Br

Isomeric SMILES

C1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=CC=CC5=C4C=CC=C5Br

InChI

InChI=1S/C24H16BrN5OS/c25-20-11-5-8-17-18(20)9-4-10-19(17)23(31)27-24(32)26-15-12-13-21-22(14-15)29-30(28-21)16-6-2-1-3-7-16/h1-14H,(H2,26,27,31,32)