AC1OAL31

2-[2-[(E)-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid

Also Known As: (2-(((3-(4-CL-PH)-5-SULFANYL-4H-1,2,4-TRIAZOL-4-YL)IMINO)ME)PHENOXY)ACETIC ACID|(E)-2-(2-(((3-(4-chlorophenyl)-5-mercapto-4H-1,2,4-triazol-4-yl)imino)methyl)phenoxy)acetic acid|{2-[(E)-{[3-(4-chlorophenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenoxy}acetic acid|2-[2-[(E)-[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic acid|2-[2-[[3-(4-chlorophenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenoxy]acetic Acid

Molecular Formula	C17H13ClN4O3S
Molecular Weight	388.0397 g/mol
LogP	3.60669
Topological Polar Surface Area	92.5 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	388.0397
Monoisotopic Mass	388.0397
Heavy Atoms	26
Complexity	1011.3475

Chemical Identifiers

CAS Number	613230-52-7
SMILES	C1=CC=C(C(=C1)/C=N/N2C(=NNC2=S)C3=CC=C(C=C3)Cl)OCC(=O)O