(2S)-N-naphthalen-1-yl-2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2S)-N-naphthalen-1-yl-2-[(5-oxidanylidene-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2S)-N-(1-naphthyl)-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: (2S)-N-(1-naphthalenyl)-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2S)-N-naphthalen-1-yl-2-[(5-oxo-4-phenethyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2S)-2-[(5-keto-4-phenethyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-naphthyl)propionamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NNC(=O)N3CCC4=CC=CC=C4

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NNC(=O)N3CCC4=CC=CC=C4

InChI

InChI=1S/C23H22N4O2S/c1-16(21(28)24-20-13-7-11-18-10-5-6-12-19(18)20)30-23-26-25-22(29)27(23)15-14-17-8-3-2-4-9-17/h2-13,16H,14-15H2,1H3,(H,24,28)(H,25,29)/t16-/m0/s1