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

Systemtic Name: N-[2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanylethanoyl]benzamide Openeye Name: N-[2-[3-(2,6-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanylacetyl]benzamide CAS Name: N-[2-[[3-(2,6-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-1-oxoethyl]benzamide IUPAC Name: N-[2-[3-(2,6-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanylacetyl]benzamide Traditional Name: N-[2-[[3-(2,6-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]acetyl]benzamide Formula: C25H21N3O3S MolecularWeight: 443.51754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O3S/c1-16-9-8-10-17(2)22(16)28-24(31)19-13-6-7-14-20(19)26-25(28)32-15-21(29)27-23(30)18-11-4-3-5-12-18/h3-14H,15H2,1-2H3,(H,27,29,30)