7-chloranyl-2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(oxolan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-3-(oxolan-2-ylmethyl)quinazolin-4-one Openeye Name: 7-chloro-2-[2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4-one CAS Name: 7-chloro-2-[[2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl]thio]-3-(2-oxolanylmethyl)-4-quinazolinone IUPAC Name: 7-chloro-2-[2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl]sulfanyl-3-(oxolan-2-ylmethyl)quinazolin-4-one Traditional Name: 7-chloro-2-[[2-(3,5-dimethylpiperidino)-2-keto-ethyl]thio]-3-(tetrahydrofurfuryl)quinazolin-4-one Formula: C22H28ClN3O3S MolecularWeight: 449.99402

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4)C

InChI

InChI=1S/C22H28ClN3O3S/c1-14-8-15(2)11-25(10-14)20(27)13-30-22-24-19-9-16(23)5-6-18(19)21(28)26(22)12-17-4-3-7-29-17/h5-6,9,14-15,17H,3-4,7-8,10-13H2,1-2H3