2-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxyethyl)ethanamide

Systemtic Name: 2-[3-(2,5-dimethylphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(2-methoxyethyl)ethanamide Openeye Name: 2-[3-(2,5-dimethylphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(2-methoxyethyl)acetamide CAS Name: 2-[[3-(2,5-dimethylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(2-methoxyethyl)acetamide IUPAC Name: 2-[3-(2,5-dimethylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(2-methoxyethyl)acetamide Traditional Name: 2-[[3-(2,5-dimethylphenyl)-4-keto-quinazolin-2-yl]thio]-N-(2-methoxyethyl)acetamide Formula: C21H23N3O3S MolecularWeight: 397.49062

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O3S/c1-14-8-9-15(2)18(12-14)24-20(26)16-6-4-5-7-17(16)23-21(24)28-13-19(25)22-10-11-27-3/h4-9,12H,10-11,13H2,1-3H3,(H,22,25)