5-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-[2-(1-methylimidazol-2-yl)sulfanylethanoylamino]-2-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: 5-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-2-phenyl-triazole-4-carboxamide CAS Name: 5-[[2-[(1-methyl-2-imidazolyl)thio]-1-oxoethyl]amino]-2-phenyl-4-triazolecarboxamide IUPAC Name: 5-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]-2-phenyltriazole-4-carboxamide Traditional Name: 5-[[2-[(1-methylimidazol-2-yl)thio]acetyl]amino]-2-phenyl-triazole-4-carboxamide Formula: C15H15N7O2S MolecularWeight: 357.3903

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)NC2=NN(N=C2C(=O)N)C3=CC=CC=C3

Isomeric SMILES

CN1C=CN=C1SCC(=O)NC2=NN(N=C2C(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C15H15N7O2S/c1-21-8-7-17-15(21)25-9-11(23)18-14-12(13(16)24)19-22(20-14)10-5-3-2-4-6-10/h2-8H,9H2,1H3,(H2,16,24)(H,18,20,23)