2-[(2-cyclopropylquinazolin-4-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one

Systemtic Name: 2-[(2-cyclopropylquinazolin-4-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one Openeye Name: 2-[(2-cyclopropylquinazolin-4-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one CAS Name: 2-[[(2-cyclopropyl-4-quinazolinyl)thio]methyl]-8-methyl-1H-quinazolin-4-one IUPAC Name: 2-[(2-cyclopropylquinazolin-4-yl)sulfanylmethyl]-8-methyl-1H-quinazolin-4-one Traditional Name: 2-[[(2-cyclopropylquinazolin-4-yl)thio]methyl]-8-methyl-1H-quinazolin-4-one Formula: C21H18N4OS MolecularWeight: 374.45882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)CSC3=NC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C21H18N4OS/c1-12-5-4-7-15-18(12)23-17(24-20(15)26)11-27-21-14-6-2-3-8-16(14)22-19(25-21)13-9-10-13/h2-8,13H,9-11H2,1H3,(H,23,24,26)