955641-45-9
4-[[[4-METHYL-2-[(PHENYLSULFONYL)AMINO]-5-THIAZOLYL]CARBONYL]AMINO]-BENZOIC ACID METHYL ESTER
Name4-[[[4-METHYL-2-[(PHENYLSULFONYL)AMINO]-5-THIAZOLYL]CARBONYL]AMINO]-BENZOIC ACID METHYL ESTER
1Identification
【Name】
4-[[[4-METHYL-2-[(PHENYLSULFONYL)AMINO]-5-THIAZOLYL]CARBONYL]AMINO]-BENZOIC ACID METHYL ESTER
【CAS】
【MDL】
MFCD15528235
【English Synonyms】
【Formula】
C19 H17 N3 O5 S2
【MolWeight】
431.491
【Inchi】
InChI=1S/C19H17N3O5S2/c1-12-16(17(23)21-14-10-8-13(9-11-14)18(24)27-2)28-19(20-12)22-29(25,26)15-6-4-3-5-7-15/h3-11H,1-2H3,(H,20,22)(H,21,23)
【InChIKey】
InChIKey=DPHUAEQZQDGKQW-UHFFFAOYSA-N
【SMILES】
Cc1c(sc(n1)NS(=O)(=O)c2ccccc2)C(=O)Nc3ccc(cc3)C(=O)OC
【MOL File】
4-[[[4-METHYL-2-[(PH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:3.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-[[[4-METHYL-2-[(PHENYLSULFONYL)AMINO]-5-THIAZOLYL]CARBONYL]AMINO]-BENZOIC ACID METHYL ESTER.cml