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

Systemtic Name: N,N-dibutyl-2-[6-iodanyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(3-benzyl-6-iodo-4-oxo-quinazolin-2-yl)sulfanyl-N,N-dibutyl-acetamide CAS Name: N,N-dibutyl-2-[[6-iodo-4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]acetamide IUPAC Name: 2-(3-benzyl-6-iodo-4-oxoquinazolin-2-yl)sulfanyl-N,N-dibutylacetamide Traditional Name: 2-[(3-benzyl-6-iodo-4-keto-quinazolin-2-yl)thio]-N,N-dibutyl-acetamide Formula: C25H30IN3O2S MolecularWeight: 563.49407

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)CSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CCCCN(CCCC)C(=O)CSC1=NC2=C(C=C(C=C2)I)C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C25H30IN3O2S/c1-3-5-14-28(15-6-4-2)23(30)18-32-25-27-22-13-12-20(26)16-21(22)24(31)29(25)17-19-10-8-7-9-11-19/h7-13,16H,3-6,14-15,17-18H2,1-2H3