4-[3-[(5-methyl-1,2-oxazol-3-yl)amino]-3-oxidanylidene-propyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[3-[(5-methyl-1,2-oxazol-3-yl)amino]-3-oxidanylidene-propyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[3-[(5-methylisoxazol-3-yl)amino]-3-oxo-propyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[3-[(5-methyl-3-isoxazolyl)amino]-3-oxopropyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[3-[(5-methyl-1,2-oxazol-3-yl)amino]-3-oxopropyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[3-keto-3-[(5-methylisoxazol-3-yl)amino]propyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate Formula: C13H12N5O2S2- MolecularWeight: 334.39668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CCN2C(=NN=C2[S-])C3=CC=CS3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CCN2C(=NN=C2[S-])C3=CC=CS3

InChI

InChI=1S/C13H13N5O2S2/c1-8-7-10(17-20-8)14-11(19)4-5-18-12(15-16-13(18)21)9-3-2-6-22-9/h2-3,6-7H,4-5H2,1H3,(H,16,21)(H,14,17,19)/p-1