1-(2-thiophen-2-ylpyrrolidin-1-yl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanone

Systemtic Name: 1-(2-thiophen-2-ylpyrrolidin-1-yl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanyl-ethanone Openeye Name: 1-[2-(2-thienyl)pyrrolidin-1-yl]-2-[2-(2-thienyl)quinazolin-4-yl]sulfanyl-ethanone CAS Name: 1-(2-thiophen-2-yl-1-pyrrolidinyl)-2-[(2-thiophen-2-yl-4-quinazolinyl)thio]ethanone IUPAC Name: 1-(2-thiophen-2-ylpyrrolidin-1-yl)-2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylethanone Traditional Name: 1-[2-(2-thienyl)pyrrolidino]-2-[[2-(2-thienyl)quinazolin-4-yl]thio]ethanone Formula: C22H19N3OS3 MolecularWeight: 437.60076

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4)C5=CC=CS5

Isomeric SMILES

C1CC(N(C1)C(=O)CSC2=NC(=NC3=CC=CC=C32)C4=CC=CS4)C5=CC=CS5

InChI

InChI=1S/C22H19N3OS3/c26-20(25-11-3-8-17(25)18-9-4-12-27-18)14-29-22-15-6-1-2-7-16(15)23-21(24-22)19-10-5-13-28-19/h1-2,4-7,9-10,12-13,17H,3,8,11,14H2