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

Systemtic Name: N-naphthalen-1-yl-2-[(5-pyridin-3-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(1-naphthyl)-2-[[5-(3-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-(1-naphthalenyl)-2-[[5-(3-pyridinyl)-1H-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-naphthalen-1-yl-2-[(5-pyridin-3-yl-1H-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(1-naphthyl)-2-[[5-(3-pyridyl)-1H-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H17N5OS MolecularWeight: 375.44688

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NNC(=N3)C4=CN=CC=C4

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=CC=CC=C21)SC3=NNC(=N3)C4=CN=CC=C4

InChI

InChI=1S/C20H17N5OS/c1-13(27-20-23-18(24-25-20)15-8-5-11-21-12-15)19(26)22-17-10-4-7-14-6-2-3-9-16(14)17/h2-13H,1H3,(H,22,26)(H,23,24,25)