(2R)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethanoylphenyl)propanamide

Systemtic Name: (2R)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethanoylphenyl)propanamide Openeye Name: (2R)-N-(3-acetylphenyl)-2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-(3-acetylphenyl)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(3-acetylphenyl)-2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(3-acetylphenyl)-2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H20N4O2S2 MolecularWeight: 412.5284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)C)SC2=NN=C(N2C3CC3)C4=CC=CS4

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC(=C1)C(=O)C)SC2=NN=C(N2C3CC3)C4=CC=CS4

InChI

InChI=1S/C20H20N4O2S2/c1-12(25)14-5-3-6-15(11-14)21-19(26)13(2)28-20-23-22-18(17-7-4-10-27-17)24(20)16-8-9-16/h3-7,10-11,13,16H,8-9H2,1-2H3,(H,21,26)/t13-/m1/s1