2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methoxyphenyl)-3-methyl-butanamide

Systemtic Name: 2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(4-methoxyphenyl)-3-methyl-butanamide Openeye Name: 2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(4-methoxyphenyl)-3-methyl-butanamide CAS Name: 2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]-N-(4-methoxyphenyl)-3-methylbutanamide IUPAC Name: 2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanyl-N-(4-methoxyphenyl)-3-methylbutanamide Traditional Name: 2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]-N-(4-methoxyphenyl)-3-methyl-butyramide Formula: C22H25N3O3S MolecularWeight: 411.5172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2N=C1SC(C(C)C)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1SC(C(C)C)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H25N3O3S/c1-5-25-21(27)17-8-6-7-9-18(17)24-22(25)29-19(14(2)3)20(26)23-15-10-12-16(28-4)13-11-15/h6-14,19H,5H2,1-4H3,(H,23,26)