2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethylazanium

Systemtic Name: 2-[(4-oxidanylidene-1H-quinazolin-2-yl)methylsulfanyl]ethylazanium Openeye Name: 2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]ethylammonium CAS Name: 2-[(4-oxo-1H-quinazolin-2-yl)methylthio]ethylammonium IUPAC Name: 2-[(4-oxo-1H-quinazolin-2-yl)methylsulfanyl]ethylazanium Traditional Name: 2-[(4-keto-1H-quinazolin-2-yl)methylthio]ethylammonium Formula: C11H14N3OS+ MolecularWeight: 236.31336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CSCC[NH3+]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CSCC[NH3+]

InChI

InChI=1S/C11H13N3OS/c12-5-6-16-7-10-13-9-4-2-1-3-8(9)11(15)14-10/h1-4H,5-7,12H2,(H,13,14,15)/p+1