180080-52-8
N-(2-methoxy-5-thioureidophenylmethyl)carbamic acid t-butyl ester
NameN-(2-methoxy-5-thioureidophenylmethyl)carbamic acid t-butyl ester
1Identification
【Name】
N-(2-methoxy-5-thioureidophenylmethyl)carbamic acid t-butyl ester
【CAS】
【MDL】
【English Synonyms】
【Formula】
C14H21N3O3S
【MolWeight】
311.4
【Inchi】
InChI=1S/C14H21N3O3S/c1-14(2,3)20-13(18)16-8-9-7-10(17-12(15)21)5-6-11(9)19-4/h5-7H,8H2,1-4H3,(H,16,18)(H3,15,17,21)
【InChIKey】
InChIKey=IGVNAQIJKJCDAK-UHFFFAOYSA-N
【SMILES】
C(C)(C)(C)OC(NCC1=C(C=CC(=C1)NC(=S)N)OC)=O
【MOL File】
N-(2-methoxy-5-thiou….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:0
XLogP3:0.0
Bulk/Fine:
3Material Safety Data Sheet(MSDS)
4CML File
N-(2-methoxy-5-thioureidophenylmethyl)carbamic acid t-butyl ester.cml