4-[2-[(4-azanyl-4-oxidanylidene-butyl)amino]-2-oxidanylidene-ethyl]-5-(3-methylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-[(4-azanyl-4-oxidanylidene-butyl)amino]-2-oxidanylidene-ethyl]-5-(3-methylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-[(4-amino-4-oxo-butyl)amino]-2-oxo-ethyl]-5-(m-tolyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-[(4-amino-4-oxobutyl)amino]-2-oxoethyl]-5-(3-methylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-[(4-amino-4-oxobutyl)amino]-2-oxoethyl]-5-(3-methylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-[(4-amino-4-keto-butyl)amino]-2-keto-ethyl]-5-(m-tolyl)-1,2,4-triazole-3-thiolate Formula: C15H18N5O2S- MolecularWeight: 332.40072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(N2CC(=O)NCCCC(=O)N)[S-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(N2CC(=O)NCCCC(=O)N)[S-]

InChI

InChI=1S/C15H19N5O2S/c1-10-4-2-5-11(8-10)14-18-19-15(23)20(14)9-13(22)17-7-3-6-12(16)21/h2,4-5,8H,3,6-7,9H2,1H3,(H2,16,21)(H,17,22)(H,19,23)/p-1