N-(2-methylphenyl)-2-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl-propyl-amino]ethanamide

Systemtic Name: N-(2-methylphenyl)-2-[2-(4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanylethanoyl-propyl-amino]ethanamide Openeye Name: 2-[[2-(3-allyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-propyl-amino]-N-(o-tolyl)acetamide CAS Name: N-(2-methylphenyl)-2-[[1-oxo-2-[(4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]ethyl]-propylamino]acetamide IUPAC Name: N-(2-methylphenyl)-2-[[2-(4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylacetyl]-propylamino]acetamide Traditional Name: 2-[[2-[(3-allyl-4-keto-quinazolin-2-yl)thio]acetyl]-propyl-amino]-N-(o-tolyl)acetamide Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1C)C(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC=C

InChI

InChI=1S/C25H28N4O3S/c1-4-14-28(16-22(30)26-20-12-8-6-10-18(20)3)23(31)17-33-25-27-21-13-9-7-11-19(21)24(32)29(25)15-5-2/h5-13H,2,4,14-17H2,1,3H3,(H,26,30)