3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-2-thioxo-1H-quinazolin-4-one Formula: C15H19N4O2S+ MolecularWeight: 319.40196

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C15H18N4O2S/c1-17-6-8-18(9-7-17)13(20)10-19-14(21)11-4-2-3-5-12(11)16-15(19)22/h2-5H,6-10H2,1H3,(H,16,22)/p+1