3-[3-(benzimidazol-1-yl)propyl]-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinazolin-4-one

Systemtic Name: 3-[3-(benzimidazol-1-yl)propyl]-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinazolin-4-one Openeye Name: 3-[3-(benzimidazol-1-yl)propyl]-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 3-[3-(1-benzimidazolyl)propyl]-2-[[(1-methyl-2-imidazolyl)thio]methyl]-4-quinazolinone IUPAC Name: 3-[3-(benzimidazol-1-yl)propyl]-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinazolin-4-one Traditional Name: 3-[3-(benzimidazol-1-yl)propyl]-2-[[(1-methylimidazol-2-yl)thio]methyl]quinazolin-4-one Formula: C23H22N6OS MolecularWeight: 430.52538

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC2=NC3=CC=CC=C3C(=O)N2CCCN4C=NC5=CC=CC=C54

Isomeric SMILES

CN1C=CN=C1SCC2=NC3=CC=CC=C3C(=O)N2CCCN4C=NC5=CC=CC=C54

InChI

InChI=1S/C23H22N6OS/c1-27-14-11-24-23(27)31-15-21-26-18-8-3-2-7-17(18)22(30)29(21)13-6-12-28-16-25-19-9-4-5-10-20(19)28/h2-5,7-11,14,16H,6,12-13,15H2,1H3