1025302-40-2
METHYL 3-((3-OXO-2-(N-PHENYLCARBAMOYL)BUT-1-ENYL)AMINO)THIOPHENE-2-CARBOXYLATE
NameMETHYL 3-((3-OXO-2-(N-PHENYLCARBAMOYL)BUT-1-ENYL)AMINO)THIOPHENE-2-CARBOXYLATE
1Identification
【Name】
METHYL 3-((3-OXO-2-(N-PHENYLCARBAMOYL)BUT-1-ENYL)AMINO)THIOPHENE-2-CARBOXYLATE
【CAS】
【MDL】
MFCD01567470
【English Synonyms】
【Formula】
C17 H16 N2 O4 S
【MolWeight】
344.389
【Inchi】
InChI=1S/C17H16N2O4S/c1-11(20)13(16(21)19-12-6-4-3-5-7-12)10-18-14-8-9-24-15(14)17(22)23-2/h3-10,18H,1-2H3,(H,19,21)/b13-10-
【InChIKey】
InChIKey=FTXDCQJWDLUMLW-RAXLEYEMSA-N
【SMILES】
CC(=O)/C(=C/Nc1ccsc1C(=O)OC)/C(=O)Nc2ccccc2
【MOL File】
METHYL 3-((3-OXO-2-(….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:6
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 3-((3-OXO-2-(N-PHENYLCARBAMOYL)BUT-1-ENYL)AMINO)THIOPHENE-2-CARBOXYLATE.cml