2-[(4-cyclopropyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(4-cyclopropyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-cyclopropyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid CAS Name: 2-[(4-cyclopropyl-5-propyl-1,2,4-triazol-3-yl)thio]acetic acid IUPAC Name: 2-[(4-cyclopropyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-cyclopropyl-5-propyl-1,2,4-triazol-3-yl)thio]acetic acid Formula: C10H15N3O2S MolecularWeight: 241.31

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2CC2)SCC(=O)O

Isomeric SMILES

CCCC1=NN=C(N1C2CC2)SCC(=O)O

InChI

InChI=1S/C10H15N3O2S/c1-2-3-8-11-12-10(16-6-9(14)15)13(8)7-4-5-7/h7H,2-6H2,1H3,(H,14,15)