3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[2-(3,5-dimethylpiperidino)-2-keto-ethyl]-2-thioxo-1H-quinazolin-4-one Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2C(=O)C3=CC=CC=C3NC2=S)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2C(=O)C3=CC=CC=C3NC2=S)C

InChI

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