532407-84-4
3,5-DICHLORO-2-[[[(3-IODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name
3,5-DICHLORO-2-[[[(3-IODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula
C15 H9 Cl2 I N2 O3 S
MolWeight
495.119
1Identification
【Name】
3,5-DICHLORO-2-[[[(3-IODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03567777
【English Synonyms】
【Formula】
C15 H9 Cl2 I N2 O3 S
【MolWeight】
495.119
【Inchi】
InChI=1S/C15H9Cl2IN2O3S/c16-8-5-10(14(22)23)12(11(17)6-8)19-15(24)20-13(21)7-2-1-3-9(18)4-7/h1-6H,(H,22,23)(H2,19,20,21,24)
【InChIKey】
InChIKey=PVLNFWVGFUVQRO-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)I)C(=O)NC(=S)Nc2c(cc(cc2Cl)Cl)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
3,5-DICHLORO-2-[[[(3-IODOBENZOYL)AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml
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