3,4-bis(chloranyl)-N-[2-[5-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: 3,4-bis(chloranyl)-N-[2-[5-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: 3,4-dichloro-N-[2-[5-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]benzamide CAS Name: 3,4-dichloro-N-[2-[5-[[2-(3-chloro-2-methylanilino)-2-oxoethyl]thio]-4-ethyl-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: 3,4-dichloro-N-[2-[5-[2-(3-chloro-2-methylanilino)-2-oxoethyl]sulfanyl-4-ethyl-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: 3,4-dichloro-N-[2-[5-[[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl]thio]-4-ethyl-1,2,4-triazol-3-yl]ethyl]benzamide Formula: C22H22Cl3N5O2S MolecularWeight: 526.86638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C(=CC=C2)Cl)C)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C(=CC=C2)Cl)C)CCNC(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H22Cl3N5O2S/c1-3-30-19(9-10-26-21(32)14-7-8-16(24)17(25)11-14)28-29-22(30)33-12-20(31)27-18-6-4-5-15(23)13(18)2/h4-8,11H,3,9-10,12H2,1-2H3,(H,26,32)(H,27,31)