methyl 3-[(4-nitrophenyl)thiocarbamoylcarbamoyl]propanoate
Molecular Formula:
C
12
H
13
N
3
O
5
S
InChI:
InChI=1/C12H13N3O5S/c1-20-11(17)7-6-10(16)14-12(21)13-8-2-4-9(5-3-8)15(18)19/h2-5H,6-7H2,1H3,(H2,13,14,16,21)/f/h13-14H
InChIKey:
InChIKey=XAPUPBXFBFKEQS-KGCNKATMCV
SMILES:
COC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)[N+](=O)[O-]
Names:
methyl 3-[(4-nitrophenyl)thiocarbamoylcarbamoyl]propanoate
Registries:
PubChem CID 4472111
PubChem ID 10190797