6-ethyl-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[[(2-methyl-4-quinazolinyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[[(2-methylquinazolin-4-yl)thio]methyl]coumarin Formula: C21H18N2O3S MolecularWeight: 378.44422

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O3S/c1-3-13-8-16-14(9-20(25)26-19(16)10-18(13)24)11-27-21-15-6-4-5-7-17(15)22-12(2)23-21/h4-10,24H,3,11H2,1-2H3