N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-cyclopropyl-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-cyclopropyl-N-(1,1-dioxothiolan-3-yl)-2-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-acetamide CAS Name: N-cyclopropyl-N-(1,1-dioxo-3-thiolanyl)-2-[(2-thiophen-2-yl-4-quinazolinyl)thio]acetamide IUPAC Name: N-cyclopropyl-N-(1,1-dioxothiolan-3-yl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-cyclopropyl-N-(1,1-diketothiolan-3-yl)-2-[[2-(2-thienyl)quinazolin-4-yl]thio]acetamide Formula: C21H21N3O3S3 MolecularWeight: 459.60474

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(C2CCS(=O)(=O)C2)C(=O)CSC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

Isomeric SMILES

C1CC1N(C2CCS(=O)(=O)C2)C(=O)CSC3=NC(=NC4=CC=CC=C43)C5=CC=CS5

InChI

InChI=1S/C21H21N3O3S3/c25-19(24(14-7-8-14)15-9-11-30(26,27)13-15)12-29-21-16-4-1-2-5-17(16)22-20(23-21)18-6-3-10-28-18/h1-6,10,14-15H,7-9,11-13H2