5-azanyl-N-[(4-chlorophenyl)methyl]-1-(3-methylsulfanylphenyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-N-[(4-chlorophenyl)methyl]-1-(3-methylsulfanylphenyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-[(4-chlorophenyl)methyl]-1-(3-methylsulfanylphenyl)triazole-4-carboxamide CAS Name: 5-amino-N-[(4-chlorophenyl)methyl]-1-[3-(methylthio)phenyl]-4-triazolecarboxamide IUPAC Name: 5-amino-N-[(4-chlorophenyl)methyl]-1-(3-methylsulfanylphenyl)triazole-4-carboxamide Traditional Name: 5-amino-N-(4-chlorobenzyl)-1-[3-(methylthio)phenyl]triazole-4-carboxamide Formula: C17H16ClN5OS MolecularWeight: 373.85984

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2C(=C(N=N2)C(=O)NCC3=CC=C(C=C3)Cl)N

Isomeric SMILES

CSC1=CC=CC(=C1)N2C(=C(N=N2)C(=O)NCC3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C17H16ClN5OS/c1-25-14-4-2-3-13(9-14)23-16(19)15(21-22-23)17(24)20-10-11-5-7-12(18)8-6-11/h2-9H,10,19H2,1H3,(H,20,24)