[3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [3-(2-azanyl-2-oxidanylidene-ethyl)-4-oxidanylidene-quinazolin-2-yl]methyl-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [3-(2-amino-2-oxo-ethyl)-4-oxo-quinazolin-2-yl]methyl-methyl-(2-thienylmethyl)ammonium CAS Name: [3-(2-amino-2-oxoethyl)-4-oxo-2-quinazolinyl]methyl-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [3-(2-amino-2-oxoethyl)-4-oxoquinazolin-2-yl]methyl-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [3-(2-amino-2-keto-ethyl)-4-keto-quinazolin-2-yl]methyl-methyl-(2-thenyl)ammonium Formula: C17H19N4O2S+ MolecularWeight: 343.42336

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CS1)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

Isomeric SMILES

C[NH+](CC1=CC=CS1)CC2=NC3=CC=CC=C3C(=O)N2CC(=O)N

InChI

InChI=1S/C17H18N4O2S/c1-20(9-12-5-4-8-24-12)11-16-19-14-7-3-2-6-13(14)17(23)21(16)10-15(18)22/h2-8H,9-11H2,1H3,(H2,18,22)/p+1