2-(4-chloranyl-3-methyl-phenoxy)-N-[[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-chloranyl-3-methyl-phenoxy)-N-[[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]ethanamide Openeye Name: 2-(4-chloro-3-methyl-phenoxy)-N-[[2-(4-ethoxyphenyl)-6-methyl-benzotriazol-5-yl]carbamothioyl]acetamide CAS Name: 2-(4-chloro-3-methylphenoxy)-N-[[[2-(4-ethoxyphenyl)-6-methyl-5-benzotriazolyl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chloro-3-methylphenoxy)-N-[[2-(4-ethoxyphenyl)-6-methylbenzotriazol-5-yl]carbamothioyl]acetamide Traditional Name: 2-(4-chloro-3-methyl-phenoxy)-N-[(6-methyl-2-p-phenetyl-benzotriazol-5-yl)thiocarbamoyl]acetamide Formula: C25H24ClN5O3S MolecularWeight: 510.00776

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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(=C(C=C4)Cl)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)COC4=CC(=C(C=C4)Cl)C)C

InChI

InChI=1S/C25H24ClN5O3S/c1-4-33-18-7-5-17(6-8-18)31-29-22-12-16(3)21(13-23(22)30-31)27-25(35)28-24(32)14-34-19-9-10-20(26)15(2)11-19/h5-13H,4,14H2,1-3H3,(H2,27,28,32,35)