2-methyl-1-(phenylmethyl)-5-sulfanyl-quinazolin-4-one

Systemtic Name: 2-methyl-1-(phenylmethyl)-5-sulfanyl-quinazolin-4-one Openeye Name: 1-benzyl-2-methyl-5-sulfanyl-quinazolin-4-one CAS Name: 5-mercapto-2-methyl-1-(phenylmethyl)-4-quinazolinone IUPAC Name: 1-benzyl-2-methyl-5-sulfanylquinazolin-4-one Traditional Name: 1-benzyl-5-mercapto-2-methyl-quinazolin-4-one Formula: C16H14N2OS MolecularWeight: 282.36016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1CC3=CC=CC=C3)C=CC=C2S

Isomeric SMILES

CC1=NC(=O)C2=C(N1CC3=CC=CC=C3)C=CC=C2S

InChI

InChI=1S/C16H14N2OS/c1-11-17-16(19)15-13(8-5-9-14(15)20)18(11)10-12-6-3-2-4-7-12/h2-9,20H,10H2,1H3