4-([(1-ETHYL-1H-PYRAZOL-4-YL)METHYL]SULFANYL)BENZOIC ACID

CAS No.
CCD No.
CCD03311134
Formula
C13 H14 N2 O2 S
MolWeight
262.332

Basic Information

Product Name: 4-([(1-ETHYL-1H-PYRAZOL-4-YL)METHYL]SULFANYL)BENZOIC ACID
English Synonyms: 4-([(1-ETHYL-1H-PYRAZOL-4-YL)METHYL]SULFANYL)BENZOIC ACID
MDL Number.: MFCD17031620
H bond acceptor: 4
H bond donor: 1
Smile: CCn1cc(cn1)CSc2ccc(cc2)C(=O)O
InChi: InChI=1S/C13H14N2O2S/c1-2-15-8-10(7-14-15)9-18-12-5-3-11(4-6-12)13(16)17/h3-8H,2,9H2,1H3,(H,16,17)
InChiKey: InChIKey=DJCAGBYGCILCPA-UHFFFAOYSA-N

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