N-[[4-(3,4-dichlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-carboxamide

Systemtic Name: N-[[4-(3,4-dichlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-carboxamide Openeye Name: N-[[4-(3,4-dichlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-carboxamide CAS Name: N-[[4-(3,4-dichlorophenyl)-5-(ethylthio)-1,2,4-triazol-3-yl]methyl]-1-naphthalenecarboxamide IUPAC Name: N-[[4-(3,4-dichlorophenyl)-5-ethylsulfanyl-1,2,4-triazol-3-yl]methyl]naphthalene-1-carboxamide Traditional Name: N-[[4-(3,4-dichlorophenyl)-5-(ethylthio)-1,2,4-triazol-3-yl]methyl]-1-naphthamide Formula: C22H18Cl2N4OS MolecularWeight: 457.37552

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC(=C(C=C2)Cl)Cl)CNC(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCSC1=NN=C(N1C2=CC(=C(C=C2)Cl)Cl)CNC(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C22H18Cl2N4OS/c1-2-30-22-27-26-20(28(22)15-10-11-18(23)19(24)12-15)13-25-21(29)17-9-5-7-14-6-3-4-8-16(14)17/h3-12H,2,13H2,1H3,(H,25,29)