4-[2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoylamino]benzamide

Systemtic Name: 4-[2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylpropanoylamino]benzamide Openeye Name: 4-[2-[3-(2,6-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylpropanoylamino]benzamide CAS Name: 4-[[2-[[3-(2,6-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[2-[3-(2,6-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylpropanoylamino]benzamide Traditional Name: 4-[2-[[3-(2,6-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]propanoylamino]benzamide Formula: C26H24N4O3S MolecularWeight: 472.55876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=C(C=C4)C(=O)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SC(C)C(=O)NC4=CC=C(C=C4)C(=O)N

InChI

InChI=1S/C26H24N4O3S/c1-15-7-6-8-16(2)22(15)30-25(33)20-9-4-5-10-21(20)29-26(30)34-17(3)24(32)28-19-13-11-18(12-14-19)23(27)31/h4-14,17H,1-3H3,(H2,27,31)(H,28,32)