N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopentyl-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopentyl-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-cyclopentyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-cyclopentyl-N-[(3S)-1,1-dioxo-3-thiolanyl]-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-cyclopentyl-N-[(3S)-1,1-dioxothiolan-3-yl]-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-cyclopentyl-N-[(3S)-1,1-diketothiolan-3-yl]-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N(C3CCCC3)C4CCS(=O)(=O)C4

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)N([C@H]3CCS(=O)(=O)C3)C4CCCC4

InChI

InChI=1S/C20H25N3O3S2/c1-14-21-18-9-5-4-8-17(18)20(22-14)27-12-19(24)23(15-6-2-3-7-15)16-10-11-28(25,26)13-16/h4-5,8-9,15-16H,2-3,6-7,10-13H2,1H3/t16-/m0/s1