2-[(4-chlorophenyl)-sulfanyl-methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(4-chlorophenyl)-sulfanyl-methyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-chlorophenyl)-sulfanyl-methyl]-1H-quinazolin-4-one CAS Name: 2-[(4-chlorophenyl)-mercaptomethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-chlorophenyl)-sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[(4-chlorophenyl)-mercapto-methyl]-1H-quinazolin-4-one Formula: C15H11ClN2OS MolecularWeight: 302.77864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)C(C3=CC=C(C=C3)Cl)S

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)C(C3=CC=C(C=C3)Cl)S

InChI

InChI=1S/C15H11ClN2OS/c16-10-7-5-9(6-8-10)13(20)14-17-12-4-2-1-3-11(12)15(19)18-14/h1-8,13,20H,(H,17,18,19)