2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)ethanamide

Systemtic Name: 2-(3,6-dimethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)ethanamide Openeye Name: 2-(3,6-dimethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)acetamide CAS Name: 2-[(3,6-dimethyl-4-oxo-2-quinazolinyl)thio]-N-(2,6-dimethylphenyl)acetamide IUPAC Name: 2-(3,6-dimethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2,6-dimethylphenyl)acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[(4-keto-3,6-dimethyl-quinazolin-2-yl)thio]acetamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SCC(=O)NC3=C(C=CC=C3C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N(C2=O)C)SCC(=O)NC3=C(C=CC=C3C)C

InChI

InChI=1S/C20H21N3O2S/c1-12-8-9-16-15(10-12)19(25)23(4)20(21-16)26-11-17(24)22-18-13(2)6-5-7-14(18)3/h5-10H,11H2,1-4H3,(H,22,24)