3-(2-piperidin-1-ium-1-ylethyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(2-piperidin-1-ium-1-ylethyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(2-piperidin-1-ium-1-ylethyl)-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-(1-piperidin-1-iumyl)ethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(2-piperidin-1-ium-1-ylethyl)-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(2-piperidin-1-ium-1-ylethyl)-2-thioxo-1H-quinazolin-4-one Formula: C15H20N3OS+ MolecularWeight: 290.4038

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

C1CC[NH+](CC1)CCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C15H19N3OS/c19-14-12-6-2-3-7-13(12)16-15(20)18(14)11-10-17-8-4-1-5-9-17/h2-3,6-7H,1,4-5,8-11H2,(H,16,20)/p+1