2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-thiophen-2-ylethylcarbamoyl)ethanamide

Systemtic Name: 2-[3-(2,6-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-thiophen-2-ylethylcarbamoyl)ethanamide Openeye Name: 2-[3-(2,6-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[2-(2-thienyl)ethylcarbamoyl]acetamide CAS Name: 2-[[3-(2,6-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-[oxo-(2-thiophen-2-ylethylamino)methyl]acetamide IUPAC Name: 2-[3-(2,6-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-thiophen-2-ylethylcarbamoyl)acetamide Traditional Name: 2-[[3-(2,6-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-[2-(2-thienyl)ethylcarbamoyl]acetamide Formula: C25H24N4O3S2 MolecularWeight: 492.61306

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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)NCCC4=CC=CS4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC(=O)NCCC4=CC=CS4

InChI

InChI=1S/C25H24N4O3S2/c1-16-7-5-8-17(2)22(16)29-23(31)19-10-3-4-11-20(19)27-25(29)34-15-21(30)28-24(32)26-13-12-18-9-6-14-33-18/h3-11,14H,12-13,15H2,1-2H3,(H2,26,28,30,32)