4-ethyl-N-[[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]carbamothioyl]benzamide

Systemtic Name: 4-ethyl-N-[[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]carbamothioyl]benzamide Openeye Name: 4-ethyl-N-[[2-(4-isopropylphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]benzamide CAS Name: 4-ethyl-N-[[[6-methyl-2-(4-propan-2-ylphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-ethyl-N-[[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]carbamothioyl]benzamide Traditional Name: 4-ethyl-N-[(6-methyl-2-p-cumenyl-benzotriazol-5-yl)thiocarbamoyl]benzamide Formula: C26H27N5OS MolecularWeight: 457.59048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2C)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC3=NN(N=C3C=C2C)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C26H27N5OS/c1-5-18-6-8-20(9-7-18)25(32)28-26(33)27-22-15-24-23(14-17(22)4)29-31(30-24)21-12-10-19(11-13-21)16(2)3/h6-16H,5H2,1-4H3,(H2,27,28,32,33)