5-azanyl-3-[(E)-2-(4-chlorophenyl)ethenyl]-N-methyl-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-3-[(E)-2-(4-chlorophenyl)ethenyl]-N-methyl-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-3-[(E)-2-(4-chlorophenyl)vinyl]-N-methyl-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-3-[(E)-2-(4-chlorophenyl)ethenyl]-N-methyl-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-3-[(E)-2-(4-chlorophenyl)ethenyl]-N-methyl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-3-[(E)-2-(4-chlorophenyl)vinyl]-N-methyl-1,2,4-triazole-1-carbothioamide Formula: C12H12ClN5S MolecularWeight: 293.77518

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)N1C(=NC(=N1)C=CC2=CC=C(C=C2)Cl)N

Isomeric SMILES

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

InChI

InChI=1S/C12H12ClN5S/c1-15-12(19)18-11(14)16-10(17-18)7-4-8-2-5-9(13)6-3-8/h2-7H,1H3,(H,15,19)(H2,14,16,17)/b7-4+