(6-methoxy-5-nitro-pyrimidin-4-yl) N,N-diethylcarbamodithioate

Systemtic Name: (6-methoxy-5-nitro-pyrimidin-4-yl) N,N-diethylcarbamodithioate Openeye Name: (6-methoxy-5-nitro-pyrimidin-4-yl) N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid (6-methoxy-5-nitro-4-pyrimidinyl) ester IUPAC Name: (6-methoxy-5-nitropyrimidin-4-yl) N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid (6-methoxy-5-nitro-pyrimidin-4-yl) ester Formula: C10H14N4O3S2 MolecularWeight: 302.37316

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SC1=NC=NC(=C1[N+](=O)[O-])OC

Isomeric SMILES

CCN(CC)C(=S)SC1=NC=NC(=C1[N+](=O)[O-])OC

InChI

InChI=1S/C10H14N4O3S2/c1-4-13(5-2)10(18)19-9-7(14(15)16)8(17-3)11-6-12-9/h6H,4-5H2,1-3H3