2,5-bis(chloranyl)-N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide

Systemtic Name: 2,5-bis(chloranyl)-N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide Openeye Name: 2,5-dichloro-N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide CAS Name: 2,5-dichloro-N-[[5-(ethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide IUPAC Name: 2,5-dichloro-N-[(5-ethylsulfanyl-4-phenyl-1,2,4-triazol-3-yl)methyl]benzamide Traditional Name: 2,5-dichloro-N-[[5-(ethylthio)-4-phenyl-1,2,4-triazol-3-yl]methyl]benzamide Formula: C18H16Cl2N4OS MolecularWeight: 407.31684

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=CC=C2)CNC(=O)C3=C(C=CC(=C3)Cl)Cl

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=CC=C2)CNC(=O)C3=C(C=CC(=C3)Cl)Cl

InChI

InChI=1S/C18H16Cl2N4OS/c1-2-26-18-23-22-16(24(18)13-6-4-3-5-7-13)11-21-17(25)14-10-12(19)8-9-15(14)20/h3-10H,2,11H2,1H3,(H,21,25)