6-iodanyl-3-(3-methoxyphenyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one

Systemtic Name: 6-iodanyl-3-(3-methoxyphenyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one Openeye Name: 6-iodo-3-(3-methoxyphenyl)-2-[(E)-2-(2-thienyl)vinyl]quinazolin-4-one CAS Name: 6-iodo-3-(3-methoxyphenyl)-2-[(E)-2-thiophen-2-ylethenyl]-4-quinazolinone IUPAC Name: 6-iodo-3-(3-methoxyphenyl)-2-[(E)-2-thiophen-2-ylethenyl]quinazolin-4-one Traditional Name: 6-iodo-3-(3-methoxyphenyl)-2-[(E)-2-(2-thienyl)vinyl]quinazolin-4-one Formula: C21H15IN2O2S MolecularWeight: 486.32547

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)C=CC4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC=CS4

InChI

InChI=1S/C21H15IN2O2S/c1-26-16-5-2-4-15(13-16)24-20(10-8-17-6-3-11-27-17)23-19-9-7-14(22)12-18(19)21(24)25/h2-13H,1H3/b10-8+