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

Systemtic Name: 2-[[5-(5-chloranyl-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-propanamide Openeye Name: 2-[[5-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(1-naphthyl)propanamide CAS Name: 2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(1-naphthalenyl)propanamide IUPAC Name: 2-[[5-(5-chloro-2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-ylpropanamide Traditional Name: 2-[[5-(5-chloro-2-methoxy-phenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(1-naphthyl)propionamide Formula: C22H19ClN4O2S MolecularWeight: 438.92986

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19ClN4O2S/c1-13(21(28)24-18-9-5-7-14-6-3-4-8-16(14)18)30-22-25-20(26-27-22)17-12-15(23)10-11-19(17)29-2/h3-13H,1-2H3,(H,24,28)(H,25,26,27)