2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-[(2R)-1-methoxypropan-2-yl]quinazolin-4-one

Systemtic Name: 2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-[(2R)-1-methoxypropan-2-yl]quinazolin-4-one Openeye Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-[(1R)-2-methoxy-1-methyl-ethyl]quinazolin-4-one CAS Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-[(2R)-1-methoxypropan-2-yl]-4-quinazolinone IUPAC Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]-3-[(2R)-1-methoxypropan-2-yl]quinazolin-4-one Traditional Name: 2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]-3-[(1R)-2-methoxy-1-methyl-ethyl]quinazolin-4-one Formula: C21H21ClN2O4S MolecularWeight: 432.92044

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC4=C(C(=C3)Cl)OCCO4

Isomeric SMILES

C[C@H](COC)N1C(=O)C2=CC=CC=C2N=C1SCC3=CC4=C(C(=C3)Cl)OCCO4

InChI

InChI=1S/C21H21ClN2O4S/c1-13(11-26-2)24-20(25)15-5-3-4-6-17(15)23-21(24)29-12-14-9-16(22)19-18(10-14)27-7-8-28-19/h3-6,9-10,13H,7-8,11-12H2,1-2H3/t13-/m1/s1