2-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethyl-diethyl-azanium

Systemtic Name: 2-(7-chloranyl-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)ethyl-diethyl-azanium Openeye Name: 2-(7-chloro-4-oxo-2-thioxo-1H-quinazolin-3-yl)ethyl-diethyl-ammonium CAS Name: 2-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)ethyl-diethylammonium IUPAC Name: 2-(7-chloro-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)ethyl-diethylazanium Traditional Name: 2-(7-chloro-4-keto-2-thioxo-1H-quinazolin-3-yl)ethyl-diethyl-ammonium Formula: C14H19ClN3OS+ MolecularWeight: 312.83816

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C(=O)C2=C(C=C(C=C2)Cl)NC1=S

Isomeric SMILES

CC[NH+](CC)CCN1C(=O)C2=C(C=C(C=C2)Cl)NC1=S

InChI

InChI=1S/C14H18ClN3OS/c1-3-17(4-2)7-8-18-13(19)11-6-5-10(15)9-12(11)16-14(18)20/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,20)/p+1