3-[2-[3-(2-acetamidoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]-4-methoxy-benzamide

Systemtic Name: 3-[2-[3-(2-acetamidoethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoylamino]-4-methoxy-benzamide Openeye Name: 3-[[2-[3-(2-acetamidoethyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]amino]-4-methoxy-benzamide CAS Name: 3-[[2-[[3-(2-acetamidoethyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]amino]-4-methoxybenzamide IUPAC Name: 3-[[2-[3-(2-acetamidoethyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]amino]-4-methoxybenzamide Traditional Name: 3-[[2-[[3-(2-acetamidoethyl)-4-keto-quinazolin-2-yl]thio]acetyl]amino]-4-methoxy-benzamide Formula: C22H23N5O5S MolecularWeight: 469.51352

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC(=C3)C(=O)N)OC

Isomeric SMILES

CC(=O)NCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=CC(=C3)C(=O)N)OC

InChI

InChI=1S/C22H23N5O5S/c1-13(28)24-9-10-27-21(31)15-5-3-4-6-16(15)26-22(27)33-12-19(29)25-17-11-14(20(23)30)7-8-18(17)32-2/h3-8,11H,9-10,12H2,1-2H3,(H2,23,30)(H,24,28)(H,25,29)