2-((4-[2-(3-METHYLPHENYL)ETHYL]-4H-1,2,4-TRIAZOL-3-YL)SULFANYL)ACETIC ACID

CAS No.
CCD No.
CCD03333417
Formula
C13 H15 N3 O2 S
MolWeight
277.346

Basic Information

Product Name: 2-((4-[2-(3-METHYLPHENYL)ETHYL]-4H-1,2,4-TRIAZOL-3-YL)SULFANYL)ACETIC ACID
English Synonyms: 2-((4-[2-(3-METHYLPHENYL)ETHYL]-4H-1,2,4-TRIAZOL-3-YL)SULFANYL)ACETIC ACID
MDL Number.: MFCD17054856
H bond acceptor: 5
H bond donor: 1
Smile: Cc1cccc(c1)CCn2cnnc2SCC(=O)O
InChi: InChI=1S/C13H15N3O2S/c1-10-3-2-4-11(7-10)5-6-16-9-14-15-13(16)19-8-12(17)18/h2-4,7,9H,5-6,8H2,1H3,(H,17,18)
InChiKey: InChIKey=ZIROLSSHWBWAQL-UHFFFAOYSA-N

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