6-methyl-4-[(4-phenylquinazolin-2-yl)sulfanylmethyl]chromen-2-one

Systemtic Name: 6-methyl-4-[(4-phenylquinazolin-2-yl)sulfanylmethyl]chromen-2-one Openeye Name: 6-methyl-4-[(4-phenylquinazolin-2-yl)sulfanylmethyl]chromen-2-one CAS Name: 6-methyl-4-[[(4-phenyl-2-quinazolinyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 6-methyl-4-[(4-phenylquinazolin-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 6-methyl-4-[[(4-phenylquinazolin-2-yl)thio]methyl]coumarin Formula: C25H18N2O2S MolecularWeight: 410.48762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=O)C=C2CSC3=NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=O)C=C2CSC3=NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C25H18N2O2S/c1-16-11-12-22-20(13-16)18(14-23(28)29-22)15-30-25-26-21-10-6-5-9-19(21)24(27-25)17-7-3-2-4-8-17/h2-14H,15H2,1H3