S-[2-[3-[4-(dimethylcarbamoylsulfanyl)quinazolin-2-yl]phenyl]quinazolin-4-yl] N,N-dimethylcarbamothioate

Systemtic Name: S-[2-[3-[4-(dimethylcarbamoylsulfanyl)quinazolin-2-yl]phenyl]quinazolin-4-yl] N,N-dimethylcarbamothioate Openeye Name: S-[2-[3-[4-(dimethylcarbamoylsulfanyl)quinazolin-2-yl]phenyl]quinazolin-4-yl] N,N-dimethylcarbamothioate CAS Name: N,N-dimethylcarbamothioic acid S-[[2-[3-[4-[[dimethylamino(oxo)methyl]thio]-2-quinazolinyl]phenyl]-4-quinazolinyl]] ester IUPAC Name: S-[2-[3-[4-(dimethylcarbamoylsulfanyl)quinazolin-2-yl]phenyl]quinazolin-4-yl] N,N-dimethylcarbamothioate Traditional Name: N,N-dimethylthiocarbamic acid S-[2-[3-[4-(dimethylcarbamoylthio)quinazolin-2-yl]phenyl]quinazolin-4-yl] ester Formula: C28H24N6O2S2 MolecularWeight: 540.65916

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)SC1=NC(=NC2=CC=CC=C21)C3=CC(=CC=C3)C4=NC5=CC=CC=C5C(=N4)SC(=O)N(C)C

Isomeric SMILES

CN(C)C(=O)SC1=NC(=NC2=CC=CC=C21)C3=CC(=CC=C3)C4=NC5=CC=CC=C5C(=N4)SC(=O)N(C)C

InChI

InChI=1S/C28H24N6O2S2/c1-33(2)27(35)37-25-19-12-5-7-14-21(19)29-23(31-25)17-10-9-11-18(16-17)24-30-22-15-8-6-13-20(22)26(32-24)38-28(36)34(3)4/h5-16H,1-4H3