(2S)-N-(2,6-dimethylphenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide

Systemtic Name: (2S)-N-(2,6-dimethylphenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide Openeye Name: (2S)-N-(2,6-dimethylphenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanyl-propanamide CAS Name: (2S)-N-(2,6-dimethylphenyl)-2-(4-thieno[2,3-d]pyrimidinylthio)propanamide IUPAC Name: (2S)-N-(2,6-dimethylphenyl)-2-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanamide Traditional Name: (2S)-N-(2,6-dimethylphenyl)-2-(thieno[2,3-d]pyrimidin-4-ylthio)propionamide Formula: C17H17N3OS2 MolecularWeight: 343.46638

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C(C)SC2=NC=NC3=C2C=CS3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)[C@H](C)SC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C17H17N3OS2/c1-10-5-4-6-11(2)14(10)20-15(21)12(3)23-17-13-7-8-22-16(13)18-9-19-17/h4-9,12H,1-3H3,(H,20,21)/t12-/m0/s1