105354-19-6
4-[[[(2,4-DICHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name4-[[[(2,4-DICHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
FormulaC15 H10 Cl2 N2 O3 S
1Identification
【Name】
4-[[[(2,4-DICHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD02815108
【English Synonyms】
【Formula】
C15 H10 Cl2 N2 O3 S
【MolWeight】
369.227
【Inchi】
InChI=1S/C15H10Cl2N2O3S/c16-9-3-6-11(12(17)7-9)13(20)19-15(23)18-10-4-1-8(2-5-10)14(21)22/h1-7H,(H,21,22)(H2,18,19,20,23)
【InChIKey】
InChIKey=AIMPAJQRVKUBCJ-UHFFFAOYSA-N
【SMILES】
c1cc(ccc1C(=O)O)NC(=S)NC(=O)c2ccc(cc2Cl)Cl
【MOL File】
4-[[[(2,4-DICHLOROBE….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[[[(2,4-DICHLOROBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml