7-chloranyl-2-(2-oxidanylidenepropylsulfanyl)-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-4-one

Systemtic Name: 7-chloranyl-2-(2-oxidanylidenepropylsulfanyl)-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-4-one Openeye Name: 2-acetonylsulfanyl-7-chloro-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-4-one CAS Name: 7-chloro-3-[[(2R)-2-oxolanyl]methyl]-2-(2-oxopropylthio)-4-quinazolinone IUPAC Name: 7-chloro-3-[[(2R)-oxolan-2-yl]methyl]-2-(2-oxopropylsulfanyl)quinazolin-4-one Traditional Name: 2-(acetonylthio)-7-chloro-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-4-one Formula: C16H17ClN2O3S MolecularWeight: 352.83578

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CC3CCCO3

Isomeric SMILES

CC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C[C@H]3CCCO3

InChI

InChI=1S/C16H17ClN2O3S/c1-10(20)9-23-16-18-14-7-11(17)4-5-13(14)15(21)19(16)8-12-3-2-6-22-12/h4-5,7,12H,2-3,6,8-9H2,1H3/t12-/m1/s1