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

Systemtic Name: 3-(3-oxidanylpropyl)-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-2-[[5-(2-thienyl)isoxazol-3-yl]methylsulfanyl]quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-2-[(5-thiophen-2-yl-3-isoxazolyl)methylthio]-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-2-[(5-thiophen-2-yl-1,2-oxazol-3-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-2-[[5-(2-thienyl)isoxazol-3-yl]methylthio]quinazolin-4-one Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NOC(=C3)C4=CC=CS4)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NOC(=C3)C4=CC=CS4)CCCO

InChI

InChI=1S/C19H17N3O3S2/c23-9-4-8-22-18(24)14-5-1-2-6-15(14)20-19(22)27-12-13-11-16(25-21-13)17-7-3-10-26-17/h1-3,5-7,10-11,23H,4,8-9,12H2