N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-2-methyl-benzamide

Systemtic Name: N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-2-methyl-benzamide Openeye Name: N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-2-methyl-benzamide CAS Name: N-[[[2-(4-methoxyphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-methylbenzamide IUPAC Name: N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]carbamothioyl]-2-methylbenzamide Traditional Name: N-[[2-(4-methoxyphenyl)benzotriazol-5-yl]thiocarbamoyl]-2-methyl-benzamide Formula: C22H19N5O2S MolecularWeight: 417.48356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2)C4=CC=C(C=C4)OC

InChI

InChI=1S/C22H19N5O2S/c1-14-5-3-4-6-18(14)21(28)24-22(30)23-15-7-12-19-20(13-15)26-27(25-19)16-8-10-17(29-2)11-9-16/h3-13H,1-2H3,(H2,23,24,28,30)