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

Systemtic Name: 3-[3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-3-oxidanylidene-propyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[3-[(3S,5S)-3,5-dimethyl-1-piperidyl]-3-oxo-propyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[3-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-3-oxopropyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-3-oxopropyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[3-[(3S,5S)-3,5-dimethylpiperidino]-3-keto-propyl]-2-thioxo-1H-quinazolin-4-one Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C(=O)CCN2C(=O)C3=CC=CC=C3NC2=S)C

InChI

InChI=1S/C18H23N3O2S/c1-12-9-13(2)11-20(10-12)16(22)7-8-21-17(23)14-5-3-4-6-15(14)19-18(21)24/h3-6,12-13H,7-11H2,1-2H3,(H,19,24)/t12-,13-/m0/s1