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

Systemtic Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)propanamide Openeye Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)propanamide CAS Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-(2,4-dimethylphenyl)propanamide IUPAC Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(2,4-dimethylphenyl)propanamide Traditional Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-(2,4-dimethylphenyl)propionamide Formula: C18H24N4OS MolecularWeight: 344.47436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NNC(=N2)C3CCCC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)SC2=NNC(=N2)C3CCCC3)C

InChI

InChI=1S/C18H24N4OS/c1-11-8-9-15(12(2)10-11)19-17(23)13(3)24-18-20-16(21-22-18)14-6-4-5-7-14/h8-10,13-14H,4-7H2,1-3H3,(H,19,23)(H,20,21,22)