5-(4-bromophenyl)-N-(3-chlorophenyl)-3-(ethylsulfanylmethyl)-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-(3-chlorophenyl)-3-(ethylsulfanylmethyl)-1,2,3-triazole-4-carboxamide Openeye Name: 5-(4-bromophenyl)-N-(3-chlorophenyl)-3-(ethylsulfanylmethyl)triazole-4-carboxamide CAS Name: 5-(4-bromophenyl)-N-(3-chlorophenyl)-3-[(ethylthio)methyl]-4-triazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-N-(3-chlorophenyl)-3-(ethylsulfanylmethyl)triazole-4-carboxamide Traditional Name: 5-(4-bromophenyl)-N-(3-chlorophenyl)-3-[(ethylthio)methyl]triazole-4-carboxamide Formula: C18H16BrClN4OS MolecularWeight: 451.76784

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Descriptors Computed from Structure

Canonical SMILES:

CCSCN1C(=C(N=N1)C2=CC=C(C=C2)Br)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCSCN1C(=C(N=N1)C2=CC=C(C=C2)Br)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H16BrClN4OS/c1-2-26-11-24-17(18(25)21-15-5-3-4-14(20)10-15)16(22-23-24)12-6-8-13(19)9-7-12/h3-10H,2,11H2,1H3,(H,21,25)