955731-01-8
2-[[(4-CHLOROPHENYL)SULFONYL]AMINO]-N-[(4-FLUOROPHENYL)METHYL]-4-METHYL-5-THIAZOLECARBOXAMIDE
Name2-[[(4-CHLOROPHENYL)SULFONYL]AMINO]-N-[(4-FLUOROPHENYL)METHYL]-4-METHYL-5-THIAZOLECARBOXAMIDE
pro_formulaC18 H15 Cl F N3 O3 S2
1Identification
【Name】
2-[[(4-CHLOROPHENYL)SULFONYL]AMINO]-N-[(4-FLUOROPHENYL)METHYL]-4-METHYL-5-THIAZOLECARBOXAMIDE
【CAS】
【MDL】
MFCD15528646
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C18 H15 Cl F N3 O3 S2
【pro_molWeight】
439.918
【Inchi】
InChI=1S/C18H15ClFN3O3S2/c1-11-16(17(24)21-10-12-2-6-14(20)7-3-12)27-18(22-11)23-28(25,26)15-8-4-13(19)5-9-15/h2-9H,10H2,1H3,(H,21,24)(H,22,23)
【InChIKey】
InChIKey=KGCPYISOSUZNLF-UHFFFAOYSA-N
【SMILES】
Cc1c(sc(n1)NS(=O)(=O)c2ccc(cc2)Cl)C(=O)NCc3ccc(cc3)F
【MOL File】
2-[[(4-CHLOROPHENYL)….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:2
pro_acceptors:6
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
2-[[(4-CHLOROPHENYL)SULFONYL]AMINO]-N-[(4-FLUOROPHENYL)METHYL]-4-METHYL-5-THIAZOLECARBOXAMIDE.cml