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

Systemtic Name: 7-chloranyl-2-[(3-methoxyphenyl)methylsulfanyl]-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-4-one Openeye Name: 7-chloro-2-[(3-methoxyphenyl)methylsulfanyl]-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-4-one CAS Name: 7-chloro-2-[(3-methoxyphenyl)methylthio]-3-[[(2R)-2-oxolanyl]methyl]-4-quinazolinone IUPAC Name: 7-chloro-2-[(3-methoxyphenyl)methylsulfanyl]-3-[[(2R)-oxolan-2-yl]methyl]quinazolin-4-one Traditional Name: 7-chloro-2-(m-anisylthio)-3-[[(2R)-tetrahydrofuran-2-yl]methyl]quinazolin-4-one Formula: C21H21ClN2O3S MolecularWeight: 416.92104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2C[C@H]4CCCO4

InChI

InChI=1S/C21H21ClN2O3S/c1-26-16-5-2-4-14(10-16)13-28-21-23-19-11-15(22)7-8-18(19)20(25)24(21)12-17-6-3-9-27-17/h2,4-5,7-8,10-11,17H,3,6,9,12-13H2,1H3/t17-/m1/s1