N-[7-iodanyl-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-6-yl]-3-(phenylsulfonyl)propanamide

Systemtic Name: N-[7-iodanyl-3-[(4-methoxyphenyl)methyl]-4-oxidanylidene-quinazolin-6-yl]-3-(phenylsulfonyl)propanamide Openeye Name: 3-(benzenesulfonyl)-N-[7-iodo-3-[(4-methoxyphenyl)methyl]-4-oxo-quinazolin-6-yl]propanamide CAS Name: 3-(benzenesulfonyl)-N-[7-iodo-3-[(4-methoxyphenyl)methyl]-4-oxo-6-quinazolinyl]propanamide IUPAC Name: 3-(benzenesulfonyl)-N-[7-iodo-3-[(4-methoxyphenyl)methyl]-4-oxoquinazolin-6-yl]propanamide Traditional Name: 3-besyl-N-(7-iodo-4-keto-3-p-anisyl-quinazolin-6-yl)propionamide Formula: C25H22IN3O5S MolecularWeight: 603.42875

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C=NC3=CC(=C(C=C3C2=O)NC(=O)CCS(=O)(=O)C4=CC=CC=C4)I

Isomeric SMILES

COC1=CC=C(C=C1)CN2C=NC3=CC(=C(C=C3C2=O)NC(=O)CCS(=O)(=O)C4=CC=CC=C4)I

InChI

InChI=1S/C25H22IN3O5S/c1-34-18-9-7-17(8-10-18)15-29-16-27-22-14-21(26)23(13-20(22)25(29)31)28-24(30)11-12-35(32,33)19-5-3-2-4-6-19/h2-10,13-14,16H,11-12,15H2,1H3,(H,28,30)