(2S)-2-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: (2S)-2-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: (2S)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide CAS Name: (2S)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: (2S)-2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: (2S)-2-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]-N-(5-propyl-1,3,4-thiadiazol-2-yl)butyramide Formula: C13H17N5O3S2 MolecularWeight: 355.43578

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)C(CC)SC2=NC(=CC(=O)N2)O

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)[C@H](CC)SC2=NC(=CC(=O)N2)O

InChI

InChI=1S/C13H17N5O3S2/c1-3-5-10-17-18-13(23-10)16-11(21)7(4-2)22-12-14-8(19)6-9(20)15-12/h6-7H,3-5H2,1-2H3,(H,16,18,21)(H2,14,15,19,20)/t7-/m0/s1