[2-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate

Systemtic Name: [2-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] pyrrolidine-1-carbodithioate Openeye Name: [2-[2-(3-methyl-4-oxo-phthalazine-1-carbonyl)hydrazino]-2-oxo-ethyl] pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [2-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(3-methyl-4-oxophthalazine-1-carbonyl)hydrazinyl]-2-oxoethyl] pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid [2-keto-2-[N'-(4-keto-3-methyl-phthalazine-1-carbonyl)hydrazino]ethyl] ester Formula: C17H19N5O3S2 MolecularWeight: 405.49446

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CSC(=S)N3CCCC3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CSC(=S)N3CCCC3

InChI

InChI=1S/C17H19N5O3S2/c1-21-16(25)12-7-3-2-6-11(12)14(20-21)15(24)19-18-13(23)10-27-17(26)22-8-4-5-9-22/h2-3,6-7H,4-5,8-10H2,1H3,(H,18,23)(H,19,24)