(2S)-N-(4-ethylphenyl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2S)-N-(4-ethylphenyl)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2S)-N-(4-ethylphenyl)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2S)-N-(4-ethylphenyl)-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]propanamide IUPAC Name: (2S)-N-(4-ethylphenyl)-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2S)-N-(4-ethylphenyl)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]propionamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C20H21N3O2S/c1-4-14-9-11-15(12-10-14)21-18(24)13(2)26-20-22-17-8-6-5-7-16(17)19(25)23(20)3/h5-13H,4H2,1-3H3,(H,21,24)/t13-/m0/s1