6-iodanyl-3-(4-methoxyphenyl)-2-[(E)-2-[2-methyl-1-(phenylmethyl)indol-3-yl]ethenyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(4-methoxyphenyl)-2-[(E)-2-[2-methyl-1-(phenylmethyl)indol-3-yl]ethenyl]quinazolin-4-one Openeye Name: 2-[(E)-2-(1-benzyl-2-methyl-indol-3-yl)vinyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4-one CAS Name: 6-iodo-3-(4-methoxyphenyl)-2-[(E)-2-[2-methyl-1-(phenylmethyl)-3-indolyl]ethenyl]-4-quinazolinone IUPAC Name: 2-[(E)-2-(1-benzyl-2-methylindol-3-yl)ethenyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4-one Traditional Name: 2-[(E)-2-(1-benzyl-2-methyl-indol-3-yl)vinyl]-6-iodo-3-(4-methoxyphenyl)quinazolin-4-one Formula: C33H26IN3O2 MolecularWeight: 623.48291

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)C=CC4=NC5=C(C=C(C=C5)I)C(=O)N4C6=CC=C(C=C6)OC

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1CC3=CC=CC=C3)/C=C/C4=NC5=C(C=C(C=C5)I)C(=O)N4C6=CC=C(C=C6)OC

InChI

InChI=1S/C33H26IN3O2/c1-22-27(28-10-6-7-11-31(28)36(22)21-23-8-4-3-5-9-23)17-19-32-35-30-18-12-24(34)20-29(30)33(38)37(32)25-13-15-26(39-2)16-14-25/h3-20H,21H2,1-2H3/b19-17+