N-(2,4-dimethylphenyl)-2-[(6-iodanyl-4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(2,4-dimethylphenyl)-2-[(6-iodanyl-4-oxidanylidene-1H-quinazolin-2-yl)sulfanyl]ethanamide Openeye Name: N-(2,4-dimethylphenyl)-2-[(6-iodo-4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide CAS Name: N-(2,4-dimethylphenyl)-2-[(6-iodo-4-oxo-1H-quinazolin-2-yl)thio]acetamide IUPAC Name: N-(2,4-dimethylphenyl)-2-[(6-iodo-4-oxo-1H-quinazolin-2-yl)sulfanyl]acetamide Traditional Name: N-(2,4-dimethylphenyl)-2-[(6-iodo-4-keto-1H-quinazolin-2-yl)thio]acetamide Formula: C18H16IN3O2S MolecularWeight: 465.30801

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC(=O)C3=C(N2)C=CC(=C3)I)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC(=O)C3=C(N2)C=CC(=C3)I)C

InChI

InChI=1S/C18H16IN3O2S/c1-10-3-5-14(11(2)7-10)20-16(23)9-25-18-21-15-6-4-12(19)8-13(15)17(24)22-18/h3-8H,9H2,1-2H3,(H,20,23)(H,21,22,24)