532419-28-6
3-[[[(3-BROMO-4-ETHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-2-METHYL-BENZOIC ACID
Name
3-[[[(3-BROMO-4-ETHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-2-METHYL-BENZOIC ACID
Formula
C18 H17 Br N2 O4 S
MolWeight
437.312
1Identification
【Name】
3-[[[(3-BROMO-4-ETHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-2-METHYL-BENZOIC ACID
【CAS】
【MDL】
MFCD03569874
【English Synonyms】
【Formula】
C18 H17 Br N2 O4 S
【MolWeight】
437.312
【Inchi】
InChI=1S/C18H17BrN2O4S/c1-3-25-15-8-7-11(9-13(15)19)16(22)21-18(26)20-14-6-4-5-12(10(14)2)17(23)24/h4-9H,3H2,1-2H3,(H,23,24)(H2,20,21,22,26)
【InChIKey】
InChIKey=FUXJLZAQSJOUIZ-UHFFFAOYSA-N
【SMILES】
CCOc1ccc(cc1Br)C(=O)NC(=S)Nc2cccc(c2C)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
3-[[[(3-BROMO-4-ETHOXYBENZOYL)AMINO]THIOXOMETHYL]AMINO]-2-METHYL-BENZOIC ACID.cml
Quick Release
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AsisChem, Inc.
Catalog No:U78281 nullnull
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Catalog No:U78281 nullnull
Country/Region:United States
Business Type:Trading Company
http://www.AsisChem.com
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