532978-47-5
2-METHYL-3-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Name
2-METHYL-3-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
Formula
C20 H22 N2 O4 S
MolWeight
386.47
1Identification
【Name】
2-METHYL-3-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID
【CAS】
【MDL】
MFCD03570527
【English Synonyms】
【Formula】
C20 H22 N2 O4 S
【MolWeight】
386.47
【Inchi】
InChI=1S/C20H22N2O4S/c1-12(2)11-26-15-9-7-14(8-10-15)18(23)22-20(27)21-17-6-4-5-16(13(17)3)19(24)25/h4-10,12H,11H2,1-3H3,(H,24,25)(H2,21,22,23,27)
【InChIKey】
InChIKey=CPJHCKOYVAMXBP-UHFFFAOYSA-N
【SMILES】
Cc1c(cccc1NC(=S)NC(=O)c2ccc(cc2)OCC(C)C)C(=O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:6
XLogP3:5.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2-METHYL-3-[[[[4-(2-METHYLPROPOXY)BENZOYL]AMINO]THIOXOMETHYL]AMINO]-BENZOIC ACID.cml
Quick Release
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Catalog No:U87777 nullnull
Country/Region:United States
Business Type:Trading Company
http://www.AsisChem.com
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