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

Systemtic Name: 2-[(4-cycloheptyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-cycloheptyl-5-isopropyl-1,2,4-triazol-3-yl)sulfanyl]acetic acid CAS Name: 2-[(4-cycloheptyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]acetic acid IUPAC Name: 2-[(4-cycloheptyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-cycloheptyl-5-isopropyl-1,2,4-triazol-3-yl)thio]acetic acid Formula: C14H23N3O2S MolecularWeight: 297.41632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1C2CCCCCC2)SCC(=O)O

Isomeric SMILES

CC(C)C1=NN=C(N1C2CCCCCC2)SCC(=O)O

InChI

InChI=1S/C14H23N3O2S/c1-10(2)13-15-16-14(20-9-12(18)19)17(13)11-7-5-3-4-6-8-11/h10-11H,3-9H2,1-2H3,(H,18,19)