N-heptan-2-yl-2-[(4-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-heptan-2-yl-2-[(4-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(1-methylhexyl)-2-[(4-methyl-5-morpholino-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-heptan-2-yl-2-[[4-methyl-5-(4-morpholinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-heptan-2-yl-2-[(4-methyl-5-morpholin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(1-methylhexyl)-2-[(4-methyl-5-morpholino-1,2,4-triazol-3-yl)thio]acetamide Formula: C16H29N5O2S MolecularWeight: 355.49876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CSC1=NN=C(N1C)N2CCOCC2

Isomeric SMILES

CCCCCC(C)NC(=O)CSC1=NN=C(N1C)N2CCOCC2

InChI

InChI=1S/C16H29N5O2S/c1-4-5-6-7-13(2)17-14(22)12-24-16-19-18-15(20(16)3)21-8-10-23-11-9-21/h13H,4-12H2,1-3H3,(H,17,22)