3-(4-chlorophenyl)-6-iodanyl-2-[(E)-2-(1-methylindol-3-yl)ethenyl]quinazolin-4-one

Systemtic Name: 3-(4-chlorophenyl)-6-iodanyl-2-[(E)-2-(1-methylindol-3-yl)ethenyl]quinazolin-4-one Openeye Name: 3-(4-chlorophenyl)-6-iodo-2-[(E)-2-(1-methylindol-3-yl)vinyl]quinazolin-4-one CAS Name: 3-(4-chlorophenyl)-6-iodo-2-[(E)-2-(1-methyl-3-indolyl)ethenyl]-4-quinazolinone IUPAC Name: 3-(4-chlorophenyl)-6-iodo-2-[(E)-2-(1-methylindol-3-yl)ethenyl]quinazolin-4-one Traditional Name: 3-(4-chlorophenyl)-6-iodo-2-[(E)-2-(1-methylindol-3-yl)vinyl]quinazolin-4-one Formula: C25H17ClIN3O MolecularWeight: 537.77945

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C2=CC=CC=C21)C=CC3=NC4=C(C=C(C=C4)I)C(=O)N3C5=CC=C(C=C5)Cl

Isomeric SMILES

CN1C=C(C2=CC=CC=C21)/C=C/C3=NC4=C(C=C(C=C4)I)C(=O)N3C5=CC=C(C=C5)Cl

InChI

InChI=1S/C25H17ClIN3O/c1-29-15-16(20-4-2-3-5-23(20)29)6-13-24-28-22-12-9-18(27)14-21(22)25(31)30(24)19-10-7-17(26)8-11-19/h2-15H,1H3/b13-6+