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

Systemtic Name: 2-chloranyl-N-[[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]carbamothioyl]benzamide Openeye Name: 2-chloro-N-[[2-(4-isopropylphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]benzamide CAS Name: 2-chloro-N-[[[6-methyl-2-(4-propan-2-ylphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-chloro-N-[[6-methyl-2-(4-propan-2-ylphenyl)benzotriazol-5-yl]carbamothioyl]benzamide Traditional Name: 2-chloro-N-[(6-methyl-2-p-cumenyl-benzotriazol-5-yl)thiocarbamoyl]benzamide Formula: C24H22ClN5OS MolecularWeight: 463.98238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C3=CC=CC=C3Cl)C4=CC=C(C=C4)C(C)C

Isomeric SMILES

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C3=CC=CC=C3Cl)C4=CC=C(C=C4)C(C)C

InChI

InChI=1S/C24H22ClN5OS/c1-14(2)16-8-10-17(11-9-16)30-28-21-12-15(3)20(13-22(21)29-30)26-24(32)27-23(31)18-6-4-5-7-19(18)25/h4-14H,1-3H3,(H2,26,27,31,32)