(2S)-2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide Openeye Name: (2S)-2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(isopropylcarbamoyl)propanamide CAS Name: (2S)-2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-[oxo-(propan-2-ylamino)methyl]propanamide IUPAC Name: (2S)-2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(propan-2-ylcarbamoyl)propanamide Traditional Name: (2S)-2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(isopropylcarbamoyl)propionamide Formula: C13H23N5O2S MolecularWeight: 313.41902

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)C(C)SC1=NNC(=N1)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC(C)C)SC1=NNC(=N1)C(C)(C)C

InChI

InChI=1S/C13H23N5O2S/c1-7(2)14-11(20)15-9(19)8(3)21-12-16-10(17-18-12)13(4,5)6/h7-8H,1-6H3,(H,16,17,18)(H2,14,15,19,20)/t8-/m0/s1