3-[2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]propanamide

Systemtic Name: 3-[2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylethanoyl-(phenylmethyl)amino]propanamide Openeye Name: 3-[benzyl-[2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]amino]propanamide CAS Name: 3-[[2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-1-oxoethyl]-(phenylmethyl)amino]propanamide IUPAC Name: 3-[benzyl-[2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylacetyl]amino]propanamide Traditional Name: 3-[benzyl-[2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]acetyl]amino]propionamide Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CCC(=O)N)CC3=CC=CC=C3

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N(CCC(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C22H24N4O3S/c1-2-26-21(29)17-10-6-7-11-18(17)24-22(26)30-15-20(28)25(13-12-19(23)27)14-16-8-4-3-5-9-16/h3-11H,2,12-15H2,1H3,(H2,23,27)