N-[(1S)-1-(4-ethylphenyl)ethyl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-[(1S)-1-(4-ethylphenyl)ethyl]-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C21H23N3OS MolecularWeight: 365.49182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C)NC(=O)CSC2=NC(=NC3=CC=CC=C32)C

InChI

InChI=1S/C21H23N3OS/c1-4-16-9-11-17(12-10-16)14(2)22-20(25)13-26-21-18-7-5-6-8-19(18)23-15(3)24-21/h5-12,14H,4,13H2,1-3H3,(H,22,25)/t14-/m0/s1