3-[2-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]methylsulfanylmethylsulfanyl]ethyl]-1H-quinazoline-2,4-dione

Systemtic Name: 3-[2-[[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]methylsulfanylmethylsulfanyl]ethyl]-1H-quinazoline-2,4-dione Openeye Name: 3-[2-[(2,4-dioxo-1H-quinazolin-3-yl)methylsulfanylmethylsulfanyl]ethyl]-1H-quinazoline-2,4-dione CAS Name: 3-[2-[[(2,4-dioxo-1H-quinazolin-3-yl)methylthio]methylthio]ethyl]-1H-quinazoline-2,4-dione IUPAC Name: 3-[2-[(2,4-dioxo-1H-quinazolin-3-yl)methylsulfanylmethylsulfanyl]ethyl]-1H-quinazoline-2,4-dione Traditional Name: 3-[2-[[(2,4-diketo-1H-quinazolin-3-yl)methylthio]methylthio]ethyl]-1H-quinazoline-2,4-quinone Formula: C20H18N4O4S2 MolecularWeight: 442.51132

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CCSCSCN3C(=O)C4=CC=CC=C4NC3=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CCSCSCN3C(=O)C4=CC=CC=C4NC3=O

InChI

InChI=1S/C20H18N4O4S2/c25-17-13-5-1-3-7-15(13)21-19(27)23(17)9-10-29-12-30-11-24-18(26)14-6-2-4-8-16(14)22-20(24)28/h1-8H,9-12H2,(H,21,27)(H,22,28)