N-[2-[6-bromanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-[6-bromanyl-3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]-2-phenyl-ethanamide Openeye Name: N-[2-(6-bromo-3-isobutyl-4-oxo-quinazolin-2-yl)sulfanylacetyl]-2-phenyl-acetamide CAS Name: N-[2-[[6-bromo-3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]-2-phenylacetamide IUPAC Name: N-[2-[6-bromo-3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]-2-phenylacetamide Traditional Name: N-[2-[(6-bromo-3-isobutyl-4-keto-quinazolin-2-yl)thio]acetyl]-2-phenyl-acetamide Formula: C22H22BrN3O3S MolecularWeight: 488.39738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C(=O)C2=C(C=CC(=C2)Br)N=C1SCC(=O)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H22BrN3O3S/c1-14(2)12-26-21(29)17-11-16(23)8-9-18(17)24-22(26)30-13-20(28)25-19(27)10-15-6-4-3-5-7-15/h3-9,11,14H,10,12-13H2,1-2H3,(H,25,27,28)