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

Systemtic Name: (2S)-N-(2-methylpropylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide Openeye Name: (2S)-N-(isobutylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide CAS Name: (2S)-N-[(2-methylpropylamino)-oxomethyl]-2-(4-thieno[2,3-d]pyrimidinylthio)propanamide IUPAC Name: (2S)-N-(2-methylpropylcarbamoyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanamide Traditional Name: (2S)-N-(isobutylcarbamoyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)propionamide Formula: C14H18N4O2S2 MolecularWeight: 338.44832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NCC(C)C)SC1=NC=NC2=C1C=CS2

InChI

InChI=1S/C14H18N4O2S2/c1-8(2)6-15-14(20)18-11(19)9(3)22-13-10-4-5-21-12(10)16-7-17-13/h4-5,7-9H,6H2,1-3H3,(H2,15,18,19,20)/t9-/m0/s1