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

Systemtic Name: 7-methoxy-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]chromen-2-one Openeye Name: 7-methoxy-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]chromen-2-one CAS Name: 7-methoxy-4-[[(2-methyl-4-quinazolinyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[(2-methylquinazolin-4-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-methoxy-4-[[(2-methylquinazolin-4-yl)thio]methyl]coumarin Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC3=CC(=O)OC4=C3C=CC(=C4)OC

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC3=CC(=O)OC4=C3C=CC(=C4)OC

InChI

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