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

Systemtic Name: 2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]ethyl carbamimidothioate Openeye Name: 2-[2-(2,4-dioxo-1H-quinazolin-3-yl)ethyl]isothiourea CAS Name: carbamimidothioic acid 2-(2,4-dioxo-1H-quinazolin-3-yl)ethyl ester IUPAC Name: 2-(2,4-dioxo-1H-quinazolin-3-yl)ethyl carbamimidothioate Traditional Name: 2-[2-(2,4-diketo-1H-quinazolin-3-yl)ethyl]isothiourea Formula: C11H12N4O2S MolecularWeight: 264.30358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CCSC(=N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=O)N2)CCSC(=N)N

InChI

InChI=1S/C11H12N4O2S/c12-10(13)18-6-5-15-9(16)7-3-1-2-4-8(7)14-11(15)17/h1-4H,5-6H2,(H3,12,13)(H,14,17)