N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[[2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[(2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]-2-phenylacetamide Traditional Name: N-[[2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]-2-phenyl-acetamide Formula: C25H19N5OS MolecularWeight: 437.51626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C25H19N5OS/c31-24(15-17-7-2-1-3-8-17)27-25(32)26-19-13-14-21-22(16-19)29-30(28-21)23-12-6-10-18-9-4-5-11-20(18)23/h1-14,16H,15H2,(H2,26,27,31,32)