diethyl-[3-(7-methoxycarbonyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propyl]azanium

Systemtic Name: diethyl-[3-(7-methoxycarbonyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)propyl]azanium Openeye Name: diethyl-[3-(7-methoxycarbonyl-4-oxo-2-thioxo-1H-quinazolin-3-yl)propyl]ammonium CAS Name: diethyl-[3-(7-methoxycarbonyl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]ammonium IUPAC Name: diethyl-[3-(7-methoxycarbonyl-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)propyl]azanium Traditional Name: 3-(7-carbomethoxy-4-keto-2-thioxo-1H-quinazolin-3-yl)propyl-diethyl-ammonium Formula: C17H24N3O3S+ MolecularWeight: 350.45576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)NC1=S

Isomeric SMILES

CC[NH+](CC)CCCN1C(=O)C2=C(C=C(C=C2)C(=O)OC)NC1=S

InChI

InChI=1S/C17H23N3O3S/c1-4-19(5-2)9-6-10-20-15(21)13-8-7-12(16(22)23-3)11-14(13)18-17(20)24/h7-8,11H,4-6,9-10H2,1-3H3,(H,18,24)/p+1