ethyl 2-[(2-methyl-3-nitro-phenyl)carbonylcarbamothioylamino]ethanoate

Systemtic Name: ethyl 2-[(2-methyl-3-nitro-phenyl)carbonylcarbamothioylamino]ethanoate Openeye Name: ethyl 2-[(2-methyl-3-nitro-benzoyl)carbamothioylamino]acetate CAS Name: 2-[[[[(2-methyl-3-nitrophenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2-methyl-3-nitrobenzoyl)carbamothioylamino]acetate Traditional Name: 2-[(2-methyl-3-nitro-benzoyl)thiocarbamoylamino]acetic acid ethyl ester Formula: C13H15N3O5S MolecularWeight: 325.3403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)NC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)CNC(=S)NC(=O)C1=C(C(=CC=C1)[N+](=O)[O-])C

InChI

InChI=1S/C13H15N3O5S/c1-3-21-11(17)7-14-13(22)15-12(18)9-5-4-6-10(8(9)2)16(19)20/h4-6H,3,7H2,1-2H3,(H2,14,15,18,22)