6-iodanyl-3-(4-methyl-2-nitro-phenyl)-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(4-methyl-2-nitro-phenyl)-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-one Openeye Name: 6-iodo-3-(4-methyl-2-nitro-phenyl)-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-one CAS Name: 6-iodo-3-(4-methyl-2-nitrophenyl)-2-[(E)-2-(2-pyridinyl)ethenyl]-4-quinazolinone IUPAC Name: 6-iodo-3-(4-methyl-2-nitrophenyl)-2-[(E)-2-pyridin-2-ylethenyl]quinazolin-4-one Traditional Name: 6-iodo-3-(4-methyl-2-nitro-phenyl)-2-[(E)-2-(2-pyridyl)vinyl]quinazolin-4-one Formula: C22H15IN4O3 MolecularWeight: 510.28397

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C22H15IN4O3/c1-14-5-9-19(20(12-14)27(29)30)26-21(10-7-16-4-2-3-11-24-16)25-18-8-6-15(23)13-17(18)22(26)28/h2-13H,1H3/b10-7+