(2S)-N-[(2S)-2-phenylbutyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide

Systemtic Name: (2S)-N-[(2S)-2-phenylbutyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide Openeye Name: (2S)-N-[(2S)-2-phenylbutyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide CAS Name: (2S)-N-[(2S)-2-phenylbutyl]-2-(4-thieno[2,3-d]pyrimidinylthio)propanamide IUPAC Name: (2S)-N-[(2S)-2-phenylbutyl]-2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanamide Traditional Name: (2S)-N-[(2S)-2-phenylbutyl]-2-(thieno[2,3-d]pyrimidin-4-ylthio)propionamide Formula: C19H21N3OS2 MolecularWeight: 371.51954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C(C)SC1=NC=NC2=C1C=CS2)C3=CC=CC=C3

Isomeric SMILES

CC[C@H](CNC(=O)[C@H](C)SC1=NC=NC2=C1C=CS2)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3OS2/c1-3-14(15-7-5-4-6-8-15)11-20-17(23)13(2)25-19-16-9-10-24-18(16)21-12-22-19/h4-10,12-14H,3,11H2,1-2H3,(H,20,23)/t13-,14+/m0/s1