(2R)-2-[[5-(3-azanyl-3-oxidanylidene-propyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide

Systemtic Name: (2R)-2-[[5-(3-azanyl-3-oxidanylidene-propyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide Openeye Name: (2R)-2-[[5-(3-amino-3-oxo-propyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide CAS Name: (2R)-2-[[5-(3-amino-3-oxopropyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-phenylpropanamide IUPAC Name: (2R)-2-[[5-(3-amino-3-oxopropyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenylpropanamide Traditional Name: (2R)-2-[[5-(3-amino-3-keto-propyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-phenyl-propionamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NC2=CC=CC=C2)CCC(=O)N

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)NC2=CC=CC=C2)CCC(=O)N

InChI

InChI=1S/C16H21N5O2S/c1-3-21-14(10-9-13(17)22)19-20-16(21)24-11(2)15(23)18-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3,(H2,17,22)(H,18,23)/t11-/m1/s1