2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2S)-heptan-2-yl]ethanamide

Systemtic Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2S)-heptan-2-yl]ethanamide Openeye Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[(1S)-1-methylhexyl]acetamide CAS Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[(2S)-heptan-2-yl]acetamide IUPAC Name: 2-[(4-cyclopropyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[(2S)-heptan-2-yl]acetamide Traditional Name: 2-[[4-cyclopropyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-[(1S)-1-methylhexyl]acetamide Formula: C18H26N4OS2 MolecularWeight: 378.55524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CSC1=NN=C(N1C2CC2)C3=CC=CS3

Isomeric SMILES

CCCCC[C@H](C)NC(=O)CSC1=NN=C(N1C2CC2)C3=CC=CS3

InChI

InChI=1S/C18H26N4OS2/c1-3-4-5-7-13(2)19-16(23)12-25-18-21-20-17(15-8-6-11-24-15)22(18)14-9-10-14/h6,8,11,13-14H,3-5,7,9-10,12H2,1-2H3,(H,19,23)/t13-/m0/s1