2-(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)ethyl cyclopropanecarboxylate

Systemtic Name: 2-(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)ethyl cyclopropanecarboxylate Openeye Name: 2-(5-phenyl-3-thioxo-1H-1,2,4-triazol-2-yl)ethyl cyclopropanecarboxylate CAS Name: cyclopropanecarboxylic acid 2-(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)ethyl ester IUPAC Name: 2-(5-phenyl-3-sulfanylidene-1H-1,2,4-triazol-2-yl)ethyl cyclopropanecarboxylate Traditional Name: cyclopropanecarboxylic acid 2-(5-phenyl-3-thioxo-1H-1,2,4-triazol-2-yl)ethyl ester Formula: C14H15N3O2S MolecularWeight: 289.3528

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)OCCN2C(=S)N=C(N2)C3=CC=CC=C3

Isomeric SMILES

C1CC1C(=O)OCCN2C(=S)N=C(N2)C3=CC=CC=C3

InChI

InChI=1S/C14H15N3O2S/c18-13(11-6-7-11)19-9-8-17-14(20)15-12(16-17)10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,15,16,20)