[2-oxidanylidene-2-[2-(4-oxidanylidene-3-phenyl-phthalazin-1-yl)hydrazinyl]ethyl] N-(4-bromophenyl)carbamodithioate

Systemtic Name: [2-oxidanylidene-2-[2-(4-oxidanylidene-3-phenyl-phthalazin-1-yl)hydrazinyl]ethyl] N-(4-bromophenyl)carbamodithioate Openeye Name: [2-oxo-2-[2-(4-oxo-3-phenyl-phthalazin-1-yl)hydrazino]ethyl] N-(4-bromophenyl)carbamodithioate CAS Name: N-(4-bromophenyl)carbamodithioic acid [2-oxo-2-[(4-oxo-3-phenyl-1-phthalazinyl)hydrazo]ethyl] ester IUPAC Name: [2-oxo-2-[2-(4-oxo-3-phenylphthalazin-1-yl)hydrazinyl]ethyl] N-(4-bromophenyl)carbamodithioate Traditional Name: N-(4-bromophenyl)carbamodithioic acid [2-keto-2-[N'-(4-keto-3-phenyl-phthalazin-1-yl)hydrazino]ethyl] ester Formula: C23H18BrN5O2S2 MolecularWeight: 540.45532

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)NNC(=O)CSC(=S)NC4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)NNC(=O)CSC(=S)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C23H18BrN5O2S2/c24-15-10-12-16(13-11-15)25-23(32)33-14-20(30)26-27-21-18-8-4-5-9-19(18)22(31)29(28-21)17-6-2-1-3-7-17/h1-13H,14H2,(H,25,32)(H,26,30)(H,27,28)