6-ethyl-7-oxidanyl-4-(quinazolin-4-ylsulfanylmethyl)chromen-2-one

Systemtic Name: 6-ethyl-7-oxidanyl-4-(quinazolin-4-ylsulfanylmethyl)chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-(quinazolin-4-ylsulfanylmethyl)chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[(4-quinazolinylthio)methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-(quinazolin-4-ylsulfanylmethyl)chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[(quinazolin-4-ylthio)methyl]coumarin Formula: C20H16N2O3S MolecularWeight: 364.41764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC=NC4=CC=CC=C43)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC=NC4=CC=CC=C43)O

InChI

InChI=1S/C20H16N2O3S/c1-2-12-7-15-13(8-19(24)25-18(15)9-17(12)23)10-26-20-14-5-3-4-6-16(14)21-11-22-20/h3-9,11,23H,2,10H2,1H3