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N-[[2-(4-ethylphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-3,5-dimethyl-benzamide

N-[[2-(4-ethylphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-3,5-dimethyl-benzamide

Systemtic Name:N-[[2-(4-ethylphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-3,5-dimethyl-benzamide
Openeye Name:N-[[2-(4-ethylphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-3,5-dimethyl-benzamide
CAS Name:N-[[[2-(4-ethylphenyl)-6-methyl-5-benzotriazolyl]amino]-sulfanylidenemethyl]-3,5-dimethylbenzamide
IUPAC Name:N-[[2-(4-ethylphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]-3,5-dimethylbenzamide
Traditional Name:N-[[2-(4-ethylphenyl)-6-methyl-benzotriazol-5-yl]thiocarbamoyl]-3,5-dimethyl-benzamide
Formula: C25H25N5OS
MolecularWeight: 443.5639
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC(=CC(=C4)C)C)C


Isomeric SMILES

CCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=CC(=CC(=C4)C)C)C


InChI

InChI=1S/C25H25N5OS/c1-5-18-6-8-20(9-7-18)30-28-22-13-17(4)21(14-23(22)29-30)26-25(32)27-24(31)19-11-15(2)10-16(3)12-19/h6-14H,5H2,1-4H3,(H2,26,27,31,32)


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