[(1S)-2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-1-thiophen-3-yl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-1-thiophen-3-yl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-1-(3-thienyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-1-(3-thiophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-(2,4-dioxo-1H-quinazolin-3-yl)-1-thiophen-3-ylethyl]-dimethylazanium Traditional Name: [(1S)-2-(2,4-diketo-1H-quinazolin-3-yl)-1-(3-thienyl)ethyl]-dimethyl-ammonium Formula: C16H18N3O2S+ MolecularWeight: 316.39802

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CN1C(=O)C2=CC=CC=C2NC1=O)C3=CSC=C3

Isomeric SMILES

C[NH+](C)[C@H](CN1C(=O)C2=CC=CC=C2NC1=O)C3=CSC=C3

InChI

InChI=1S/C16H17N3O2S/c1-18(2)14(11-7-8-22-10-11)9-19-15(20)12-5-3-4-6-13(12)17-16(19)21/h3-8,10,14H,9H2,1-2H3,(H,17,21)/p+1/t14-/m1/s1