5-azanyl-N-[[3,5-bis(chloranyl)-4-naphthalen-1-ylsulfanyl-phenyl]methyl]-2H-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-N-[[3,5-bis(chloranyl)-4-naphthalen-1-ylsulfanyl-phenyl]methyl]-2H-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-N-[[3,5-dichloro-4-(1-naphthylsulfanyl)phenyl]methyl]-2H-triazole-4-carboxamide CAS Name: 5-amino-N-[[3,5-dichloro-4-(1-naphthalenylthio)phenyl]methyl]-2H-triazole-4-carboxamide IUPAC Name: 5-amino-N-[(3,5-dichloro-4-naphthalen-1-ylsulfanylphenyl)methyl]-2H-triazole-4-carboxamide Traditional Name: 5-amino-N-[3,5-dichloro-4-(1-naphthylthio)benzyl]-2H-triazole-4-carboxamide Formula: C20H15Cl2N5OS MolecularWeight: 444.337

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2SC3=C(C=C(C=C3Cl)CNC(=O)C4=NNN=C4N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2SC3=C(C=C(C=C3Cl)CNC(=O)C4=NNN=C4N)Cl

InChI

InChI=1S/C20H15Cl2N5OS/c21-14-8-11(10-24-20(28)17-19(23)26-27-25-17)9-15(22)18(14)29-16-7-3-5-12-4-1-2-6-13(12)16/h1-9H,10H2,(H,24,28)(H3,23,25,26,27)