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

Systemtic Name: 3-[4-(3-methylpiperidin-1-yl)-4-oxidanylidene-butyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[4-(3-methyl-1-piperidyl)-4-oxo-butyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[4-(3-methyl-1-piperidinyl)-4-oxobutyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[4-(3-methylpiperidin-1-yl)-4-oxobutyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[4-keto-4-(3-methylpiperidino)butyl]-2-thioxo-1H-quinazolin-4-one Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CC1CCCN(C1)C(=O)CCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C18H23N3O2S/c1-13-6-4-10-20(12-13)16(22)9-5-11-21-17(23)14-7-2-3-8-15(14)19-18(21)24/h2-3,7-8,13H,4-6,9-12H2,1H3,(H,19,24)