2-[[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[[5-(4-chlorophenyl)oxazol-2-yl]methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[[5-(4-chlorophenyl)-2-oxazolyl]methylthio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[[5-(4-chlorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[[5-(4-chlorophenyl)oxazol-2-yl]methylthio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C21H18ClN3O3S MolecularWeight: 427.90392

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC=C(O3)C4=CC=C(C=C4)Cl)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC=C(O3)C4=CC=C(C=C4)Cl)CCCO

InChI

InChI=1S/C21H18ClN3O3S/c22-15-8-6-14(7-9-15)18-12-23-19(28-18)13-29-21-24-17-5-2-1-4-16(17)20(27)25(21)10-3-11-26/h1-2,4-9,12,26H,3,10-11,13H2