6-iodanyl-2-[(2-oxidanylidene-1-propyl-indol-3-ylidene)methyl]-3-phenethyl-quinazolin-4-one

Systemtic Name: 6-iodanyl-2-[(2-oxidanylidene-1-propyl-indol-3-ylidene)methyl]-3-phenethyl-quinazolin-4-one Openeye Name: 6-iodo-2-[(2-oxo-1-propyl-indolin-3-ylidene)methyl]-3-phenethyl-quinazolin-4-one CAS Name: 6-iodo-2-[(2-oxo-1-propyl-3-indolylidene)methyl]-3-phenethyl-4-quinazolinone IUPAC Name: 6-iodo-2-[(2-oxo-1-propylindol-3-ylidene)methyl]-3-phenethylquinazolin-4-one Traditional Name: 6-iodo-2-[(2-keto-1-propyl-indolin-3-ylidene)methyl]-3-phenethyl-quinazolin-4-one Formula: C28H24IN3O2 MolecularWeight: 561.41353

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=CC3=NC4=C(C=C(C=C4)I)C(=O)N3CCC5=CC=CC=C5)C1=O

Isomeric SMILES

CCCN1C2=CC=CC=C2C(=CC3=NC4=C(C=C(C=C4)I)C(=O)N3CCC5=CC=CC=C5)C1=O

InChI

InChI=1S/C28H24IN3O2/c1-2-15-31-25-11-7-6-10-21(25)22(27(31)33)18-26-30-24-13-12-20(29)17-23(24)28(34)32(26)16-14-19-8-4-3-5-9-19/h3-13,17-18H,2,14-16H2,1H3