N-(2,3-dimethylphenyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(2,3-dimethylphenyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-butanamide Openeye Name: N-(2,3-dimethylphenyl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-butanamide CAS Name: N-(2,3-dimethylphenyl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]butanamide IUPAC Name: N-(2,3-dimethylphenyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylbutanamide Traditional Name: N-(2,3-dimethylphenyl)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]butyramide Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1C)C)SC2=NC3=CC=CC=C3C(=O)N2CC

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1C)C)SC2=NC3=CC=CC=C3C(=O)N2CC

InChI

InChI=1S/C22H25N3O2S/c1-5-19(20(26)23-17-13-9-10-14(3)15(17)4)28-22-24-18-12-8-7-11-16(18)21(27)25(22)6-2/h7-13,19H,5-6H2,1-4H3,(H,23,26)