3-(5-methylpyridin-2-yl)-2-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(5-methylpyridin-2-yl)-2-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propylsulfanyl]quinazolin-4-one Openeye Name: 3-(5-methyl-2-pyridyl)-2-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]quinazolin-4-one CAS Name: 3-(5-methyl-2-pyridinyl)-2-[3-(2-oxo-3H-benzimidazol-1-yl)propylthio]-4-quinazolinone IUPAC Name: 3-(5-methylpyridin-2-yl)-2-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]quinazolin-4-one Traditional Name: 2-[3-(2-keto-3H-benzimidazol-1-yl)propylthio]-3-(5-methyl-2-pyridyl)quinazolin-4-one Formula: C24H21N5O2S MolecularWeight: 443.52084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCCN4C5=CC=CC=C5NC4=O

Isomeric SMILES

CC1=CN=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCCCN4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C24H21N5O2S/c1-16-11-12-21(25-15-16)29-22(30)17-7-2-3-8-18(17)27-24(29)32-14-6-13-28-20-10-5-4-9-19(20)26-23(28)31/h2-5,7-12,15H,6,13-14H2,1H3,(H,26,31)