2-[3-(4-chloranylphenoxy)propylsulfanyl]-3-[(2S)-1-methoxypropan-2-yl]quinazolin-4-one

Systemtic Name: 2-[3-(4-chloranylphenoxy)propylsulfanyl]-3-[(2S)-1-methoxypropan-2-yl]quinazolin-4-one Openeye Name: 2-[3-(4-chlorophenoxy)propylsulfanyl]-3-[(1S)-2-methoxy-1-methyl-ethyl]quinazolin-4-one CAS Name: 2-[3-(4-chlorophenoxy)propylthio]-3-[(2S)-1-methoxypropan-2-yl]-4-quinazolinone IUPAC Name: 2-[3-(4-chlorophenoxy)propylsulfanyl]-3-[(2S)-1-methoxypropan-2-yl]quinazolin-4-one Traditional Name: 2-[3-(4-chlorophenoxy)propylthio]-3-[(1S)-2-methoxy-1-methyl-ethyl]quinazolin-4-one Formula: C21H23ClN2O3S MolecularWeight: 418.93692

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C(=O)C2=CC=CC=C2N=C1SCCCOC3=CC=C(C=C3)Cl

Isomeric SMILES

C[C@@H](COC)N1C(=O)C2=CC=CC=C2N=C1SCCCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O3S/c1-15(14-26-2)24-20(25)18-6-3-4-7-19(18)23-21(24)28-13-5-12-27-17-10-8-16(22)9-11-17/h3-4,6-11,15H,5,12-14H2,1-2H3/t15-/m0/s1