2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-propan-2-yl-quinazolin-4-one

Systemtic Name: 2-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-3-propan-2-yl-quinazolin-4-one Openeye Name: 3-isopropyl-2-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 2-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-3-propan-2-yl-4-quinazolinone IUPAC Name: 2-(2-oxo-2-piperidin-1-ylethyl)sulfanyl-3-propan-2-ylquinazolin-4-one Traditional Name: 3-isopropyl-2-[(2-keto-2-piperidino-ethyl)thio]quinazolin-4-one Formula: C18H23N3O2S MolecularWeight: 345.45912

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCCCC3

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCCCC3

InChI

InChI=1S/C18H23N3O2S/c1-13(2)21-17(23)14-8-4-5-9-15(14)19-18(21)24-12-16(22)20-10-6-3-7-11-20/h4-5,8-9,13H,3,6-7,10-12H2,1-2H3