736162-68-8
(3-[(2,5-DIMETHYL-PHENYLCARBAMOYL)-METHYL]-4-OXO-THIAZOLIDIN-2-YLIDENE)-ACETIC ACID ETHYL ESTER
Name(3-[(2,5-DIMETHYL-PHENYLCARBAMOYL)-METHYL]-4-OXO-THIAZOLIDIN-2-YLIDENE)-ACETIC ACID ETHYL ESTER
1Identification
【Name】
(3-[(2,5-DIMETHYL-PHENYLCARBAMOYL)-METHYL]-4-OXO-THIAZOLIDIN-2-YLIDENE)-ACETIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD04606919
【English Synonyms】
【Formula】
C17 H20 N2 O4 S
【MolWeight】
348.421
【Inchi】
InChI=1S/C17H20N2O4S/c1-4-23-17(22)8-16-19(15(21)10-24-16)9-14(20)18-13-7-11(2)5-6-12(13)3/h5-8H,4,9-10H2,1-3H3,(H,18,20)/b16-8-
【InChIKey】
InChIKey=GRJJYTYYBUHFAJ-PXNMLYILSA-N
【SMILES】
CCOC(=O)/C=C\1/N(C(=O)CS1)CC(=O)Nc2cc(ccc2C)C
【MOL File】
(3-[(2,5-DIMETHYL-PH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
(3-[(2,5-DIMETHYL-PHENYLCARBAMOYL)-METHYL]-4-OXO-THIAZOLIDIN-2-YLIDENE)-ACETIC ACID ETHYL ESTER.cml