6-chloranyl-3-methyl-5-(phenylmethylsulfanyl)quinazolin-4-one

Systemtic Name: 6-chloranyl-3-methyl-5-(phenylmethylsulfanyl)quinazolin-4-one Openeye Name: 5-benzylsulfanyl-6-chloro-3-methyl-quinazolin-4-one CAS Name: 6-chloro-3-methyl-5-(phenylmethylthio)-4-quinazolinone IUPAC Name: 5-benzylsulfanyl-6-chloro-3-methylquinazolin-4-one Traditional Name: 5-(benzylthio)-6-chloro-3-methyl-quinazolin-4-one Formula: C16H13ClN2OS MolecularWeight: 316.80522

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C(C1=O)C(=C(C=C2)Cl)SCC3=CC=CC=C3

Isomeric SMILES

CN1C=NC2=C(C1=O)C(=C(C=C2)Cl)SCC3=CC=CC=C3

InChI

InChI=1S/C16H13ClN2OS/c1-19-10-18-13-8-7-12(17)15(14(13)16(19)20)21-9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3