5-azanyl-3-(4-chlorophenyl)-N-propan-2-yl-1,2,4-triazole-1-carbothioamide

Systemtic Name: 5-azanyl-3-(4-chlorophenyl)-N-propan-2-yl-1,2,4-triazole-1-carbothioamide Openeye Name: 5-amino-3-(4-chlorophenyl)-N-isopropyl-1,2,4-triazole-1-carbothioamide CAS Name: 5-amino-3-(4-chlorophenyl)-N-propan-2-yl-1,2,4-triazole-1-carbothioamide IUPAC Name: 5-amino-3-(4-chlorophenyl)-N-propan-2-yl-1,2,4-triazole-1-carbothioamide Traditional Name: 5-amino-3-(4-chlorophenyl)-N-isopropyl-1,2,4-triazole-1-carbothioamide Formula: C12H14ClN5S MolecularWeight: 295.79106

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClN5S/c1-7(2)15-12(19)18-11(14)16-10(17-18)8-3-5-9(13)6-4-8/h3-7H,1-2H3,(H,15,19)(H2,14,16,17)