N-[(6-methyl-2-naphthalen-1-yl-benzotriazol-5-yl)carbamothioyl]-2-phenyl-ethanamide

Systemtic Name: N-[(6-methyl-2-naphthalen-1-yl-benzotriazol-5-yl)carbamothioyl]-2-phenyl-ethanamide Openeye Name: N-[[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]-2-phenyl-acetamide CAS Name: N-[[[6-methyl-2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-phenylacetamide IUPAC Name: N-[(6-methyl-2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]-2-phenylacetamide Traditional Name: N-[[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]-2-phenyl-acetamide Formula: C26H21N5OS MolecularWeight: 451.54284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)CC3=CC=CC=C3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)CC3=CC=CC=C3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H21N5OS/c1-17-14-22-23(30-31(29-22)24-13-7-11-19-10-5-6-12-20(19)24)16-21(17)27-26(33)28-25(32)15-18-8-3-2-4-9-18/h2-14,16H,15H2,1H3,(H2,27,28,32,33)