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

Systemtic Name: 7-ethyl-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-ethyl-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-ethyl-4-[[(2-methyl-4-quinazolinyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-ethyl-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-ethyl-4-[[(2-methylquinazolin-4-yl)thio]methyl]coumarin Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC(=NC4=CC=CC=C43)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC(=NC4=CC=CC=C43)C

InChI

InChI=1S/C21H18N2O2S/c1-3-14-8-9-16-15(11-20(24)25-19(16)10-14)12-26-21-17-6-4-5-7-18(17)22-13(2)23-21/h4-11H,3,12H2,1-2H3