2-[3-(2-methylprop-2-enyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(E)-(phenylmethylidene)amino]ethanamide

Systemtic Name: 2-[3-(2-methylprop-2-enyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(E)-(phenylmethylidene)amino]ethanamide Openeye Name: N-[(E)-benzylideneamino]-2-[3-(2-methylallyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: 2-[[3-(2-methylprop-2-enyl)-4-oxo-2-quinazolinyl]thio]-N-[(E)-(phenylmethylene)amino]acetamide IUPAC Name: N-[(E)-benzylideneamino]-2-[3-(2-methylprop-2-enyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-[(E)-benzalamino]-2-[[4-keto-3-(2-methylallyl)quinazolin-2-yl]thio]acetamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NN=CC3=CC=CC=C3

Isomeric SMILES

CC(=C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N/N=C/C3=CC=CC=C3

InChI

InChI=1S/C21H20N4O2S/c1-15(2)13-25-20(27)17-10-6-7-11-18(17)23-21(25)28-14-19(26)24-22-12-16-8-4-3-5-9-16/h3-12H,1,13-14H2,2H3,(H,24,26)/b22-12+