(2S)-N-ethyl-2-[2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylethanoylamino]propanamide

Systemtic Name: (2S)-N-ethyl-2-[2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylethanoylamino]propanamide Openeye Name: (2S)-N-ethyl-2-[[2-[2-(2-thienyl)quinazolin-4-yl]sulfanylacetyl]amino]propanamide CAS Name: (2S)-N-ethyl-2-[[1-oxo-2-[(2-thiophen-2-yl-4-quinazolinyl)thio]ethyl]amino]propanamide IUPAC Name: (2S)-N-ethyl-2-[[2-(2-thiophen-2-ylquinazolin-4-yl)sulfanylacetyl]amino]propanamide Traditional Name: (2S)-N-ethyl-2-[[2-[[2-(2-thienyl)quinazolin-4-yl]thio]acetyl]amino]propionamide Formula: C19H20N4O2S2 MolecularWeight: 400.5177

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CSC1=NC(=NC2=CC=CC=C21)C3=CC=CS3

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CSC1=NC(=NC2=CC=CC=C21)C3=CC=CS3

InChI

InChI=1S/C19H20N4O2S2/c1-3-20-18(25)12(2)21-16(24)11-27-19-13-7-4-5-8-14(13)22-17(23-19)15-9-6-10-26-15/h4-10,12H,3,11H2,1-2H3,(H,20,25)(H,21,24)/t12-/m0/s1