(2R)-N-(2,5-dimethylphenyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(2,5-dimethylphenyl)-2-(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(2,5-dimethylphenyl)-2-(3-ethyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(2,5-dimethylphenyl)-2-[(3-ethyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(2,5-dimethylphenyl)-2-(3-ethyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(2,5-dimethylphenyl)-2-[(3-ethyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C21H23N3O2S MolecularWeight: 381.49122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2N=C1S[C@H](C)C(=O)NC3=C(C=CC(=C3)C)C

InChI

InChI=1S/C21H23N3O2S/c1-5-24-20(26)16-8-6-7-9-17(16)23-21(24)27-15(4)19(25)22-18-12-13(2)10-11-14(18)3/h6-12,15H,5H2,1-4H3,(H,22,25)/t15-/m1/s1