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

Systemtic Name: 6-iodanyl-3-(2-methylphenyl)-2-[(Z)-(2-oxidanylidene-1-propyl-indol-3-ylidene)methyl]quinazolin-4-one Openeye Name: 6-iodo-3-(o-tolyl)-2-[(Z)-(2-oxo-1-propyl-indolin-3-ylidene)methyl]quinazolin-4-one CAS Name: 6-iodo-3-(2-methylphenyl)-2-[(Z)-(2-oxo-1-propyl-3-indolylidene)methyl]-4-quinazolinone IUPAC Name: 6-iodo-3-(2-methylphenyl)-2-[(Z)-(2-oxo-1-propylindol-3-ylidene)methyl]quinazolin-4-one Traditional Name: 6-iodo-2-[(Z)-(2-keto-1-propyl-indolin-3-ylidene)methyl]-3-(o-tolyl)quinazolin-4-one Formula: C27H22IN3O2 MolecularWeight: 547.38695

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2C(=CC3=NC4=C(C=C(C=C4)I)C(=O)N3C5=CC=CC=C5C)C1=O

Isomeric SMILES

CCCN1C2=CC=CC=C2/C(=C/C3=NC4=C(C=C(C=C4)I)C(=O)N3C5=CC=CC=C5C)/C1=O

InChI

InChI=1S/C27H22IN3O2/c1-3-14-30-24-11-7-5-9-19(24)20(26(30)32)16-25-29-22-13-12-18(28)15-21(22)27(33)31(25)23-10-6-4-8-17(23)2/h4-13,15-16H,3,14H2,1-2H3/b20-16-