2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxy-5-morpholin-4-ylsulfonyl-phenyl)ethanamide

Systemtic Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxy-5-morpholin-4-ylsulfonyl-phenyl)ethanamide Openeye Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxy-5-morpholinosulfonyl-phenyl)acetamide CAS Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-[2-ethoxy-5-(4-morpholinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)acetamide Traditional Name: 2-[(5-cyclopropyl-4-ethyl-1,2,4-triazol-3-yl)thio]-N-(2-ethoxy-5-morpholinosulfonyl-phenyl)acetamide Formula: C21H29N5O5S2 MolecularWeight: 495.61546

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OCC)C4CC4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)OCC)C4CC4

InChI

InChI=1S/C21H29N5O5S2/c1-3-26-20(15-5-6-15)23-24-21(26)32-14-19(27)22-17-13-16(7-8-18(17)31-4-2)33(28,29)25-9-11-30-12-10-25/h7-8,13,15H,3-6,9-12,14H2,1-2H3,(H,22,27)