2-[6-iodanyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-dipropyl-ethanamide

Systemtic Name: 2-[6-iodanyl-3-(3-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-dipropyl-ethanamide Openeye Name: 2-[6-iodo-3-(m-tolyl)-4-oxo-quinazolin-2-yl]sulfanyl-N,N-dipropyl-acetamide CAS Name: 2-[[6-iodo-3-(3-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N,N-dipropylacetamide IUPAC Name: 2-[6-iodo-3-(3-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N,N-dipropylacetamide Traditional Name: 2-[[6-iodo-4-keto-3-(m-tolyl)quinazolin-2-yl]thio]-N,N-dipropyl-acetamide Formula: C23H26IN3O2S MolecularWeight: 535.44091

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)CSC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC(=C3)C

Isomeric SMILES

CCCN(CCC)C(=O)CSC1=NC2=C(C=C(C=C2)I)C(=O)N1C3=CC=CC(=C3)C

InChI

InChI=1S/C23H26IN3O2S/c1-4-11-26(12-5-2)21(28)15-30-23-25-20-10-9-17(24)14-19(20)22(29)27(23)18-8-6-7-16(3)13-18/h6-10,13-14H,4-5,11-12,15H2,1-3H3