2-[4-oxidanylidene-2-[(2,3,5,6-tetramethylphenyl)sulfanylmethyl]quinazolin-3-yl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-2-[(2,3,5,6-tetramethylphenyl)sulfanylmethyl]quinazolin-3-yl]ethanamide Openeye Name: 2-[4-oxo-2-[(2,3,5,6-tetramethylphenyl)sulfanylmethyl]quinazolin-3-yl]acetamide CAS Name: 2-[4-oxo-2-[[(2,3,5,6-tetramethylphenyl)thio]methyl]-3-quinazolinyl]acetamide IUPAC Name: 2-[4-oxo-2-[(2,3,5,6-tetramethylphenyl)sulfanylmethyl]quinazolin-3-yl]acetamide Traditional Name: 2-[4-keto-2-[[(2,3,5,6-tetramethylphenyl)thio]methyl]quinazolin-3-yl]acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)SCC2=NC3=CC=CC=C3C(=O)N2CC(=O)N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)SCC2=NC3=CC=CC=C3C(=O)N2CC(=O)N)C)C

InChI

InChI=1S/C21H23N3O2S/c1-12-9-13(2)15(4)20(14(12)3)27-11-19-23-17-8-6-5-7-16(17)21(26)24(19)10-18(22)25/h5-9H,10-11H2,1-4H3,(H2,22,25)