N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-ethoxy-3-piperidin-1-ylsulfonyl-phenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[4-ethoxy-3-(1-piperidylsulfonyl)phenyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-[4-ethoxy-3-(1-piperidinylsulfonyl)phenyl]-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(4-ethoxy-3-piperidinosulfonyl-phenyl)-2-[(5-propyl-1H-1,2,4-triazol-3-yl)thio]acetamide Formula: C20H29N5O4S2 MolecularWeight: 467.60536

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC(=NN1)SCC(=O)NC2=CC(=C(C=C2)OCC)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCCC1=NC(=NN1)SCC(=O)NC2=CC(=C(C=C2)OCC)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H29N5O4S2/c1-3-8-18-22-20(24-23-18)30-14-19(26)21-15-9-10-16(29-4-2)17(13-15)31(27,28)25-11-6-5-7-12-25/h9-10,13H,3-8,11-12,14H2,1-2H3,(H,21,26)(H,22,23,24)