5-[3-[(2-chlorophenyl)amino]-3-oxidanylidene-propyl]-1H-1,2,4-triazole-3-thiolate

Systemtic Name: 5-[3-[(2-chlorophenyl)amino]-3-oxidanylidene-propyl]-1H-1,2,4-triazole-3-thiolate Openeye Name: 5-[3-(2-chloroanilino)-3-oxo-propyl]-1H-1,2,4-triazole-3-thiolate CAS Name: 5-[3-(2-chloroanilino)-3-oxopropyl]-1H-1,2,4-triazole-3-thiolate IUPAC Name: 5-[3-(2-chloroanilino)-3-oxopropyl]-1H-1,2,4-triazole-3-thiolate Traditional Name: 5-[3-(2-chloroanilino)-3-keto-propyl]-1H-1,2,4-triazole-3-thiolate Formula: C11H10ClN4OS- MolecularWeight: 281.7413

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCC2=NC(=NN2)[S-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCC2=NC(=NN2)[S-])Cl

InChI

InChI=1S/C11H11ClN4OS/c12-7-3-1-2-4-8(7)13-10(17)6-5-9-14-11(18)16-15-9/h1-4H,5-6H2,(H,13,17)(H2,14,15,16,18)/p-1