5-azanyl-3-(4-chloranylnaphthalen-1-yl)-N-methyl-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-3-(4-chloranylnaphthalen-1-yl)-N-methyl-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-3-(4-chloro-1-naphthyl)-N-methyl-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-3-(4-chloro-1-naphthalenyl)-N-methyl-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-3-(4-chloronaphthalen-1-yl)-N-methyl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-3-(4-chloro-1-naphthyl)-N-methyl-1,2,4-triazole-1-carbothioamide Formula: C14H12ClN5S MolecularWeight: 317.79658

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(=NC(=N1)C2=CC=C(C3=CC=CC=C32)Cl)N

Isomeric SMILES

CNC(=S)N1C(=NC(=N1)C2=CC=C(C3=CC=CC=C32)Cl)N

InChI

InChI=1S/C14H12ClN5S/c1-17-14(21)20-13(16)18-12(19-20)10-6-7-11(15)9-5-3-2-4-8(9)10/h2-7H,1H3,(H,17,21)(H2,16,18,19)