2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]butanoic acid

Systemtic Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]butanoic acid Openeye Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]butanoic acid CAS Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]butanoic acid IUPAC Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]butanoic acid Traditional Name: 2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]butyric acid Formula: C12H17N3O2S MolecularWeight: 267.34728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)SC1=NN=C(N1C2CC2)C3CC3

Isomeric SMILES

CCC(C(=O)O)SC1=NN=C(N1C2CC2)C3CC3

InChI

InChI=1S/C12H17N3O2S/c1-2-9(11(16)17)18-12-14-13-10(7-3-4-7)15(12)8-5-6-8/h7-9H,2-6H2,1H3,(H,16,17)