2,4-bis(chloranyl)-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[[2-(4-ethoxyphenyl)-5-benzotriazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[[2-(4-ethoxyphenyl)benzotriazol-5-yl]carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[(2-p-phenetylbenzotriazol-5-yl)thiocarbamoyl]benzamide Formula: C22H17Cl2N5O2S MolecularWeight: 486.37368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17Cl2N5O2S/c1-2-31-16-7-5-15(6-8-16)29-27-19-10-4-14(12-20(19)28-29)25-22(32)26-21(30)17-9-3-13(23)11-18(17)24/h3-12H,2H2,1H3,(H2,25,26,30,32)