2-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[(5-chloranyl-2-methoxy-phenyl)methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[(5-chloro-2-methoxy-phenyl)methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[(5-chloro-2-methoxyphenyl)methylthio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[(5-chloro-2-methoxyphenyl)methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[(5-chloro-2-methoxy-benzyl)thio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C19H19ClN2O3S MolecularWeight: 390.88376

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C19H19ClN2O3S/c1-25-17-8-7-14(20)11-13(17)12-26-19-21-16-6-3-2-5-15(16)18(24)22(19)9-4-10-23/h2-3,5-8,11,23H,4,9-10,12H2,1H3