(2S)-2-(3-ethyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-propyl-propanamide

Systemtic Name: (2S)-2-(3-ethyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-propyl-propanamide Openeye Name: (2S)-2-[3-ethyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-propyl-propanamide CAS Name: (2S)-2-[(3-ethyl-4-oxo-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl)thio]-N-propylpropanamide IUPAC Name: (2S)-2-(3-ethyl-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-propylpropanamide Traditional Name: (2S)-2-[[3-ethyl-4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-propyl-propionamide Formula: C18H21N3O2S3 MolecularWeight: 407.57324

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1CC

Isomeric SMILES

CCCNC(=O)[C@H](C)SC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1CC

InChI

InChI=1S/C18H21N3O2S3/c1-4-8-19-15(22)11(3)26-18-20-16-14(17(23)21(18)5-2)12(10-25-16)13-7-6-9-24-13/h6-7,9-11H,4-5,8H2,1-3H3,(H,19,22)/t11-/m0/s1