4-[3-[(3-METHYLPHENYL)THIO]-6-OXOPYRIDAZIN-1(6H)-YL]BENZOIC ACID

CAS No.
CCD No.
CCD03264166
Formula
C18 H14 N2 O3 S
MolWeight
338.386

Basic Information

Product Name: 4-[3-[(3-METHYLPHENYL)THIO]-6-OXOPYRIDAZIN-1(6H)-YL]BENZOIC ACID
English Synonyms: 4-[3-[(3-METHYLPHENYL)THIO]-6-OXOPYRIDAZIN-1(6H)-YL]BENZOIC ACID
MDL Number.: MFCD16992453
H bond acceptor: 5
H bond donor: 1
Smile: Cc1cccc(c1)Sc2ccc(=O)n(n2)c3ccc(cc3)C(=O)O
InChi: InChI=1S/C18H14N2O3S/c1-12-3-2-4-15(11-12)24-16-9-10-17(21)20(19-16)14-7-5-13(6-8-14)18(22)23/h2-11H,1H3,(H,22,23)
InChiKey: InChIKey=XCFJKAOXBBRDSV-UHFFFAOYSA-N

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