2-[[4-ethyl-5-[(2-oxidanylideneazepan-1-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-propanamide

Systemtic Name: 2-[[4-ethyl-5-[(2-oxidanylideneazepan-1-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-propanamide Openeye Name: 2-[[4-ethyl-5-[(2-oxoazepan-1-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-(1-naphthyl)propanamide CAS Name: 2-[[4-ethyl-5-[(2-oxo-1-azepanyl)methyl]-1,2,4-triazol-3-yl]thio]-N-(1-naphthalenyl)propanamide IUPAC Name: 2-[[4-ethyl-5-[(2-oxoazepan-1-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-ylpropanamide Traditional Name: 2-[[4-ethyl-5-[(2-ketoazepan-1-yl)methyl]-1,2,4-triazol-3-yl]thio]-N-(1-naphthyl)propionamide Formula: C24H29N5O2S MolecularWeight: 451.58436

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C(=O)NC2=CC=CC3=CC=CC=C32)CN4CCCCCC4=O

Isomeric SMILES

CCN1C(=NN=C1SC(C)C(=O)NC2=CC=CC3=CC=CC=C32)CN4CCCCCC4=O

InChI

InChI=1S/C24H29N5O2S/c1-3-29-21(16-28-15-8-4-5-14-22(28)30)26-27-24(29)32-17(2)23(31)25-20-13-9-11-18-10-6-7-12-19(18)20/h6-7,9-13,17H,3-5,8,14-16H2,1-2H3,(H,25,31)