(([3-METHYL-1-(3-METHYLPHENYL)-5-(1H-PYRROL-1-YL)-1H-PYRAZOL-4-YL]METHYL)THIO)ACETIC ACID

CAS No.
CCD No.
CCD03262626
Formula
C18 H19 N3 O2 S
MolWeight
341.433

Basic Information

Product Name: (([3-METHYL-1-(3-METHYLPHENYL)-5-(1H-PYRROL-1-YL)-1H-PYRAZOL-4-YL]METHYL)THIO)ACETIC ACID
English Synonyms: (([3-METHYL-1-(3-METHYLPHENYL)-5-(1H-PYRROL-1-YL)-1H-PYRAZOL-4-YL]METHYL)THIO)ACETIC ACID
MDL Number.: MFCD16990913
H bond acceptor: 5
H bond donor: 1
Smile: Cc1cccc(c1)n2c(c(c(n2)C)CSCC(=O)O)n3cccc3
InChi: InChI=1S/C18H19N3O2S/c1-13-6-5-7-15(10-13)21-18(20-8-3-4-9-20)16(14(2)19-21)11-24-12-17(22)23/h3-10H,11-12H2,1-2H3,(H,22,23)
InChiKey: InChIKey=MAUFHIYQGGZHCW-UHFFFAOYSA-N

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