2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-fluoranyl-4-methyl-phenyl)propanamide

Systemtic Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-fluoranyl-4-methyl-phenyl)propanamide Openeye Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-fluoro-4-methyl-phenyl)propanamide CAS Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-(3-fluoro-4-methylphenyl)propanamide IUPAC Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)propanamide Traditional Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(3-fluoro-4-methyl-phenyl)propionamide Formula: C19H19FN4OS2 MolecularWeight: 402.508763

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=C(N2C3CC3)C4=CC=CS4)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SC2=NN=C(N2C3CC3)C4=CC=CS4)F

InChI

InChI=1S/C19H19FN4OS2/c1-11-5-6-13(10-15(11)20)21-18(25)12(2)27-19-23-22-17(16-4-3-9-26-16)24(19)14-7-8-14/h3-6,9-10,12,14H,7-8H2,1-2H3,(H,21,25)