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

Systemtic Name: N-[(6-methyl-2-naphthalen-1-yl-benzotriazol-5-yl)carbamothioyl]-2-phenoxy-ethanamide Openeye Name: N-[[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]carbamothioyl]-2-phenoxy-acetamide CAS Name: N-[[[6-methyl-2-(1-naphthalenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-phenoxyacetamide IUPAC Name: N-[(6-methyl-2-naphthalen-1-ylbenzotriazol-5-yl)carbamothioyl]-2-phenoxyacetamide Traditional Name: N-[[6-methyl-2-(1-naphthyl)benzotriazol-5-yl]thiocarbamoyl]-2-phenoxy-acetamide Formula: C26H21N5O2S MolecularWeight: 467.54224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)COC3=CC=CC=C3)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)COC3=CC=CC=C3)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C26H21N5O2S/c1-17-14-22-23(30-31(29-22)24-13-7-9-18-8-5-6-12-20(18)24)15-21(17)27-26(34)28-25(32)16-33-19-10-3-2-4-11-19/h2-15H,16H2,1H3,(H2,27,28,32,34)