(7-methoxycarbonyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: (7-methoxycarbonyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: (7-methoxycarbonyl-4-oxo-1H-quinazolin-2-yl)methyl-methyl-(2-thienylmethyl)ammonium CAS Name: (7-methoxycarbonyl-4-oxo-1H-quinazolin-2-yl)methyl-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: (7-methoxycarbonyl-4-oxo-1H-quinazolin-2-yl)methyl-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: (7-carbomethoxy-4-keto-1H-quinazolin-2-yl)methyl-methyl-(2-thenyl)ammonium Formula: C17H18N3O3S+ MolecularWeight: 344.40812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CS1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

Isomeric SMILES

C[NH+](CC1=CC=CS1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C17H17N3O3S/c1-20(9-12-4-3-7-24-12)10-15-18-14-8-11(17(22)23-2)5-6-13(14)16(21)19-15/h3-8H,9-10H2,1-2H3,(H,18,19,21)/p+1