6-iodanyl-3-(2-methoxyphenyl)-2-pentylsulfanyl-quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(2-methoxyphenyl)-2-pentylsulfanyl-quinazolin-4-one Openeye Name: 6-iodo-3-(2-methoxyphenyl)-2-pentylsulfanyl-quinazolin-4-one CAS Name: 6-iodo-3-(2-methoxyphenyl)-2-(pentylthio)-4-quinazolinone IUPAC Name: 6-iodo-3-(2-methoxyphenyl)-2-pentylsulfanylquinazolin-4-one Traditional Name: 2-(amylthio)-6-iodo-3-(2-methoxyphenyl)quinazolin-4-one Formula: C20H21IN2O2S MolecularWeight: 480.36241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC=C3OC

Isomeric SMILES

CCCCCSC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC=C3OC

InChI

InChI=1S/C20H21IN2O2S/c1-3-4-7-12-26-20-22-16-11-10-14(21)13-15(16)19(24)23(20)17-8-5-6-9-18(17)25-2/h5-6,8-11,13H,3-4,7,12H2,1-2H3