[2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate

Systemtic Name: [2-[(2-nitrophenyl)amino]-2-oxidanylidene-ethyl] N,N-diethylcarbamodithioate Openeye Name: [2-(2-nitroanilino)-2-oxo-ethyl] N,N-diethylcarbamodithioate CAS Name: N,N-diethylcarbamodithioic acid [2-(2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-nitroanilino)-2-oxoethyl] N,N-diethylcarbamodithioate Traditional Name: N,N-diethylcarbamodithioic acid [2-keto-2-(2-nitroanilino)ethyl] ester Formula: C13H17N3O3S2 MolecularWeight: 327.42238

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(=O)NC1=CC=CC=C1[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=S)SCC(=O)NC1=CC=CC=C1[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3S2/c1-3-15(4-2)13(20)21-9-12(17)14-10-7-5-6-8-11(10)16(18)19/h5-8H,3-4,9H2,1-2H3,(H,14,17)