3-[3-(3-methylpiperidin-1-yl)-3-oxidanylidene-propyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[3-(3-methylpiperidin-1-yl)-3-oxidanylidene-propyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[3-(3-methyl-1-piperidyl)-3-oxo-propyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[3-(3-methyl-1-piperidinyl)-3-oxopropyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[3-(3-methylpiperidin-1-yl)-3-oxopropyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[3-keto-3-(3-methylpiperidino)propyl]-2-thioxo-1H-quinazolin-4-one Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CC1CCCN(C1)C(=O)CCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C17H21N3O2S/c1-12-5-4-9-19(11-12)15(21)8-10-20-16(22)13-6-2-3-7-14(13)18-17(20)23/h2-3,6-7,12H,4-5,8-11H2,1H3,(H,18,23)