N-[[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-2-(2-methylphenoxy)ethanamide

Systemtic Name: N-[[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-2-(2-methylphenoxy)ethanamide Openeye Name: N-[[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]-2-(2-methylphenoxy)acetamide CAS Name: N-[[[2-(4-ethoxyphenyl)-6-methyl-5-benzotriazolyl]amino]-sulfanylidenemethyl]-2-(2-methylphenoxy)acetamide IUPAC Name: N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]-2-(2-methylphenoxy)acetamide Traditional Name: 2-(2-methylphenoxy)-N-[(6-methyl-2-p-phenetyl-benzotriazol-5-yl)thiocarbamoyl]acetamide Formula: C25H25N5O3S MolecularWeight: 475.5627

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)COC4=CC=CC=C4C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)COC4=CC=CC=C4C)C

InChI

InChI=1S/C25H25N5O3S/c1-4-32-19-11-9-18(10-12-19)30-28-21-13-17(3)20(14-22(21)29-30)26-25(34)27-24(31)15-33-23-8-6-5-7-16(23)2/h5-14H,4,15H2,1-3H3,(H2,26,27,31,34)