2-[[5-[[(4-iodophenyl)amino]methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanehydrazide

Systemtic Name: 2-[[5-[[(4-iodophenyl)amino]methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanehydrazide Openeye Name: 2-[[5-[(4-iodoanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetohydrazide CAS Name: 2-[[5-[(4-iodoanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetohydrazide IUPAC Name: 2-[[5-[(4-iodoanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetohydrazide Traditional Name: 2-[[5-[(4-iodoanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetohydrazide Formula: C17H17IN6OS MolecularWeight: 480.32595

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN)CNC3=CC=C(C=C3)I

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN)CNC3=CC=C(C=C3)I

InChI

InChI=1S/C17H17IN6OS/c18-12-6-8-13(9-7-12)20-10-15-22-23-17(26-11-16(25)21-19)24(15)14-4-2-1-3-5-14/h1-9,20H,10-11,19H2,(H,21,25)