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

Systemtic Name: 7-chloranyl-2-[(2-methylphenyl)methylsulfanyl]-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-4-one Openeye Name: 7-chloro-2-(o-tolylmethylsulfanyl)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-4-one CAS Name: 7-chloro-2-[(2-methylphenyl)methylthio]-3-[[(2R)-2-oxolanyl]methyl]-4-quinazolinone IUPAC Name: 7-chloro-2-[(2-methylphenyl)methylsulfanyl]-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-4-one Traditional Name: 7-chloro-2-[(2-methylbenzyl)thio]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-4-one Formula: C21H21ClN2O2S MolecularWeight: 400.92164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C[C@H]4CCCO4

InChI

InChI=1S/C21H21ClN2O2S/c1-14-5-2-3-6-15(14)13-27-21-23-19-11-16(22)8-9-18(19)20(25)24(21)12-17-7-4-10-26-17/h2-3,5-6,8-9,11,17H,4,7,10,12-13H2,1H3/t17-/m1/s1