AC1LUGMI

(Z)-3-(5-chloro-2-methoxyphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid

Also Known As: (Z)-3-(5-chloro-2-methoxyphenyl)-2-((5-methyl-4H-1,2,4-triazol-3-yl)thio)acrylic acid|(2Z)-3-(5-chloro-2-methoxyphenyl)-2-[(3-methyl-1H-1,2,4-triazol-4-ium-5-yl)sulfanyl]prop-2-enoate|(2Z)-3-(5-chloro-2-methoxyphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid|(Z)-3-(5-chloro-2-methoxyphenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic acid|3-(5-chloro-2-methoxy-phenyl)-2-[(5-methyl-1H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoic Acid

Molecular Formula	C13H12ClN3O3S
Molecular Weight	325.02878 g/mol
LogP	2.99292
Topological Polar Surface Area	88.1 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	325.02878
Monoisotopic Mass	325.02878
Heavy Atoms	21
Complexity	699.72

Chemical Identifiers

CAS Number	577990-58-0
SMILES	CC1=NC(=NN1)S/C(=C\C2=C(C=CC(=C2)Cl)OC)/C(=O)O