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

Systemtic Name: 3-[2-(2-ethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[2-(2-ethyl-1-piperidyl)-2-oxo-ethyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-(2-ethyl-1-piperidinyl)-2-oxoethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[2-(2-ethylpiperidino)-2-keto-ethyl]-2-thioxo-1H-quinazolin-4-one Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)CN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CCC1CCCCN1C(=O)CN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C17H21N3O2S/c1-2-12-7-5-6-10-19(12)15(21)11-20-16(22)13-8-3-4-9-14(13)18-17(20)23/h3-4,8-9,12H,2,5-7,10-11H2,1H3,(H,18,23)