(2R)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)propanamide

Systemtic Name: (2R)-2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)propanamide Openeye Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)propanamide CAS Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(5-tert-butyl-2-phenyl-3-pyrazolyl)propanamide IUPAC Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(5-tert-butyl-2-phenylpyrazol-3-yl)propanamide Traditional Name: (2R)-2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(5-tert-butyl-2-phenyl-pyrazol-3-yl)propionamide Formula: C18H23N7OS MolecularWeight: 385.48652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=NN1C2=CC=CC=C2)C(C)(C)C)SC3=NNC(=N3)N

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=NN1C2=CC=CC=C2)C(C)(C)C)SC3=NNC(=N3)N

InChI

InChI=1S/C18H23N7OS/c1-11(27-17-21-16(19)22-23-17)15(26)20-14-10-13(18(2,3)4)24-25(14)12-8-6-5-7-9-12/h5-11H,1-4H3,(H,20,26)(H3,19,21,22,23)/t11-/m1/s1