2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-quinazolin-4-one

Systemtic Name: 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-methyl-quinazolin-4-one Openeye Name: 2-[2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-3-methyl-quinazolin-4-one CAS Name: 2-[[2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl]thio]-3-methyl-4-quinazolinone IUPAC Name: 2-[2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-methylquinazolin-4-one Traditional Name: 2-[[2-(2,6-dimethylpiperidino)-2-keto-ethyl]thio]-3-methyl-quinazolin-4-one Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C)C

Isomeric SMILES

CC1CCCC(N1C(=O)CSC2=NC3=CC=CC=C3C(=O)N2C)C

InChI

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