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

Systemtic Name: 6-iodanyl-2-[(1-methyl-2-oxidanylidene-indol-3-ylidene)methyl]-3-phenethyl-quinazolin-4-one Openeye Name: 6-iodo-2-[(1-methyl-2-oxo-indolin-3-ylidene)methyl]-3-phenethyl-quinazolin-4-one CAS Name: 6-iodo-2-[(1-methyl-2-oxo-3-indolylidene)methyl]-3-phenethyl-4-quinazolinone IUPAC Name: 6-iodo-2-[(1-methyl-2-oxoindol-3-ylidene)methyl]-3-phenethylquinazolin-4-one Traditional Name: 6-iodo-2-[(2-keto-1-methyl-indolin-3-ylidene)methyl]-3-phenethyl-quinazolin-4-one Formula: C26H20IN3O2 MolecularWeight: 533.36037

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=CC3=NC4=C(C=C(C=C4)I)C(=O)N3CCC5=CC=CC=C5)C1=O

Isomeric SMILES

CN1C2=CC=CC=C2C(=CC3=NC4=C(C=C(C=C4)I)C(=O)N3CCC5=CC=CC=C5)C1=O

InChI

InChI=1S/C26H20IN3O2/c1-29-23-10-6-5-9-19(23)20(25(29)31)16-24-28-22-12-11-18(27)15-21(22)26(32)30(24)14-13-17-7-3-2-4-8-17/h2-12,15-16H,13-14H2,1H3