2-[(4-azanyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-diethylphenyl)propanamide

Systemtic Name: 2-[(4-azanyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-diethylphenyl)propanamide Openeye Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-diethylphenyl)propanamide CAS Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]-N-(2,6-diethylphenyl)propanamide IUPAC Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2,6-diethylphenyl)propanamide Traditional Name: 2-[(4-amino-5-propyl-1,2,4-triazol-3-yl)thio]-N-(2,6-diethylphenyl)propionamide Formula: C18H27N5OS MolecularWeight: 361.50488

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1N)SC(C)C(=O)NC2=C(C=CC=C2CC)CC

Isomeric SMILES

CCCC1=NN=C(N1N)SC(C)C(=O)NC2=C(C=CC=C2CC)CC

InChI

InChI=1S/C18H27N5OS/c1-5-9-15-21-22-18(23(15)19)25-12(4)17(24)20-16-13(6-2)10-8-11-14(16)7-3/h8,10-12H,5-7,9,19H2,1-4H3,(H,20,24)