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

Systemtic Name: (2R)-2-[[5-(3-azanyl-3-oxidanylidene-propyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-2-yl-propanamide Openeye Name: (2R)-2-[[5-(3-amino-3-oxo-propyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-naphthyl)propanamide CAS Name: (2R)-2-[[5-(3-amino-3-oxopropyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(2-naphthalenyl)propanamide IUPAC Name: (2R)-2-[[5-(3-amino-3-oxopropyl)-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-2-ylpropanamide Traditional Name: (2R)-2-[[5-(3-amino-3-keto-propyl)-4-ethyl-1,2,4-triazol-3-yl]thio]-N-(2-naphthyl)propionamide Formula: C20H23N5O2S MolecularWeight: 397.49392

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NC2=CC3=CC=CC=C3C=C2)CCC(=O)N

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C(=O)NC2=CC3=CC=CC=C3C=C2)CCC(=O)N

InChI

InChI=1S/C20H23N5O2S/c1-3-25-18(11-10-17(21)26)23-24-20(25)28-13(2)19(27)22-16-9-8-14-6-4-5-7-15(14)12-16/h4-9,12-13H,3,10-11H2,1-2H3,(H2,21,26)(H,22,27)/t13-/m1/s1