[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2,5-bis(oxidanylidene)pyrrolidine-1-carbodithioate

Systemtic Name: [2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2,5-bis(oxidanylidene)pyrrolidine-1-carbodithioate Openeye Name: [2-(2-methyl-4-nitro-anilino)-2-oxo-ethyl] 2,5-dioxopyrrolidine-1-carbodithioate CAS Name: 2,5-dioxo-1-pyrrolidinecarbodithioic acid [2-(2-methyl-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-4-nitroanilino)-2-oxoethyl] 2,5-dioxopyrrolidine-1-carbodithioate Traditional Name: 2,5-diketopyrrolidine-1-carbodithioic acid [2-keto-2-(2-methyl-4-nitro-anilino)ethyl] ester Formula: C14H13N3O5S2 MolecularWeight: 367.40012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC(=S)N2C(=O)CCC2=O

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CSC(=S)N2C(=O)CCC2=O

InChI

InChI=1S/C14H13N3O5S2/c1-8-6-9(17(21)22)2-3-10(8)15-11(18)7-24-14(23)16-12(19)4-5-13(16)20/h2-3,6H,4-5,7H2,1H3,(H,15,18)