3-[2-(3-chlorophenyl)ethyl]-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 3-[2-(3-chlorophenyl)ethyl]-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 3-[2-(3-chlorophenyl)ethyl]-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 3-[2-(3-chlorophenyl)ethyl]-2-[[(1-methyl-2-imidazolyl)thio]methyl]-4-quinazolinone IUPAC Name: 3-[2-(3-chlorophenyl)ethyl]-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 3-[2-(3-chlorophenyl)ethyl]-2-[[(1-methylimidazol-2-yl)thio]methyl]quinazolin-4-one Formula: C21H19ClN4OS MolecularWeight: 410.91976

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=NC3=CC=CC=C3C(=O)N2CCC4=CC(=CC=C4)Cl

Isomeric SMILES

CN1C=CN=C1SCC2=NC3=CC=CC=C3C(=O)N2CCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C21H19ClN4OS/c1-25-12-10-23-21(25)28-14-19-24-18-8-3-2-7-17(18)20(27)26(19)11-9-15-5-4-6-16(22)13-15/h2-8,10,12-13H,9,11,14H2,1H3