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

Systemtic Name: 3-[(2S)-butan-2-yl]-2-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propylsulfanyl]quinazolin-4-one Openeye Name: 3-[(1S)-1-methylpropyl]-2-[3-(2-oxo-3H-benzimidazol-1-yl)propylsulfanyl]quinazolin-4-one CAS Name: 3-[(2S)-butan-2-yl]-2-[3-(2-oxo-3H-benzimidazol-1-yl)propylthio]-4-quinazolinone IUPAC Name: 3-[(2S)-butan-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-[(1S)-1-methylpropyl]quinazolin-4-one Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(=O)C2=CC=CC=C2N=C1SCCCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

CC[C@H](C)N1C(=O)C2=CC=CC=C2N=C1SCCCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C22H24N4O2S/c1-3-15(2)26-20(27)16-9-4-5-10-17(16)24-22(26)29-14-8-13-25-19-12-7-6-11-18(19)23-21(25)28/h4-7,9-12,15H,3,8,13-14H2,1-2H3,(H,23,28)/t15-/m0/s1