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

Systemtic Name: (2R)-2-[(4-azanyl-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(cyclohexylcarbamoyl)propanamide Openeye Name: (2R)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(cyclohexylcarbamoyl)propanamide CAS Name: (2R)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-[(cyclohexylamino)-oxomethyl]propanamide IUPAC Name: (2R)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)sulfanyl]-N-(cyclohexylcarbamoyl)propanamide Traditional Name: (2R)-2-[(4-amino-5-tert-butyl-1,2,4-triazol-3-yl)thio]-N-(cyclohexylcarbamoyl)propionamide Formula: C16H28N6O2S MolecularWeight: 368.49752

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC1CCCCC1)SC2=NN=C(N2N)C(C)(C)C

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC1CCCCC1)SC2=NN=C(N2N)C(C)(C)C

InChI

InChI=1S/C16H28N6O2S/c1-10(25-15-21-20-13(22(15)17)16(2,3)4)12(23)19-14(24)18-11-8-6-5-7-9-11/h10-11H,5-9,17H2,1-4H3,(H2,18,19,23,24)/t10-/m1/s1