(2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-naphthalen-2-yl-propanamide

Systemtic Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-naphthalen-2-yl-propanamide Openeye Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-naphthyl)propanamide CAS Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-(2-naphthalenyl)propanamide IUPAC Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-naphthalen-2-ylpropanamide Traditional Name: (2R)-2-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]-N-(2-naphthyl)propionamide Formula: C21H22N4OS MolecularWeight: 378.49058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=CC=CC=C2C=C1)SC3=NN=C(N3C4CC4)C5CC5

Isomeric SMILES

C[C@H](C(=O)NC1=CC2=CC=CC=C2C=C1)SC3=NN=C(N3C4CC4)C5CC5

InChI

InChI=1S/C21H22N4OS/c1-13(20(26)22-17-9-8-14-4-2-3-5-16(14)12-17)27-21-24-23-19(15-6-7-15)25(21)18-10-11-18/h2-5,8-9,12-13,15,18H,6-7,10-11H2,1H3,(H,22,26)/t13-/m1/s1