2-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one

Systemtic Name: 2-[(7-ethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one Openeye Name: 2-[(7-ethyl-2-oxo-chromen-4-yl)methylsulfanyl]-3-(tetrahydrofuran-2-ylmethyl)quinazolin-4-one CAS Name: 2-[(7-ethyl-2-oxo-1-benzopyran-4-yl)methylthio]-3-(2-oxolanylmethyl)-4-quinazolinone IUPAC Name: 2-[(7-ethyl-2-oxochromen-4-yl)methylsulfanyl]-3-(oxolan-2-ylmethyl)quinazolin-4-one Traditional Name: 2-[(7-ethyl-2-keto-chromen-4-yl)methylthio]-3-(tetrahydrofurfuryl)quinazolin-4-one Formula: C25H24N2O4S MolecularWeight: 448.53406

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3CC5CCCO5

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC4=CC=CC=C4C(=O)N3CC5CCCO5

InChI

InChI=1S/C25H24N2O4S/c1-2-16-9-10-19-17(13-23(28)31-22(19)12-16)15-32-25-26-21-8-4-3-7-20(21)24(29)27(25)14-18-6-5-11-30-18/h3-4,7-10,12-13,18H,2,5-6,11,14-15H2,1H3