5-(2-[(CYANOMETHYL)SULFANYL]ACETAMIDO)-2,3-DIMETHYLBENZOIC ACID

CAS No.
CCD No.
CCD03675524
Formula
C13 H14 N2 O3 S
MolWeight
278.331

Basic Information

Product Name: 5-(2-[(CYANOMETHYL)SULFANYL]ACETAMIDO)-2,3-DIMETHYLBENZOIC ACID
English Synonyms: 5-(2-[(CYANOMETHYL)SULFANYL]ACETAMIDO)-2,3-DIMETHYLBENZOIC ACID
MDL Number.: MFCD17420925
H bond acceptor: 5
H bond donor: 2
Smile: Cc1cc(cc(c1C)C(=O)O)NC(=O)CSCC#N
InChi: InChI=1S/C13H14N2O3S/c1-8-5-10(6-11(9(8)2)13(17)18)15-12(16)7-19-4-3-14/h5-6H,4,7H2,1-2H3,(H,15,16)(H,17,18)
InChiKey: InChIKey=NZLXKERBHZYKML-UHFFFAOYSA-N

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