(2S)-2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide

Systemtic Name: (2S)-2-(4-azanyl-5-cyano-pyrimidin-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide Openeye Name: (2S)-2-(4-amino-5-cyano-pyrimidin-2-yl)sulfanyl-N-(2-thienylmethyl)propanamide CAS Name: (2S)-2-[(4-amino-5-cyano-2-pyrimidinyl)thio]-N-(thiophen-2-ylmethyl)propanamide IUPAC Name: (2S)-2-(4-amino-5-cyanopyrimidin-2-yl)sulfanyl-N-(thiophen-2-ylmethyl)propanamide Traditional Name: (2S)-2-[(4-amino-5-cyano-pyrimidin-2-yl)thio]-N-(2-thenyl)propionamide Formula: C13H13N5OS2 MolecularWeight: 319.40522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CS1)SC2=NC=C(C(=N2)N)C#N

Isomeric SMILES

C[C@@H](C(=O)NCC1=CC=CS1)SC2=NC=C(C(=N2)N)C#N

InChI

InChI=1S/C13H13N5OS2/c1-8(12(19)16-7-10-3-2-4-20-10)21-13-17-6-9(5-14)11(15)18-13/h2-4,6,8H,7H2,1H3,(H,16,19)(H2,15,17,18)/t8-/m0/s1