2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide

Systemtic Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxy-phenyl)ethanamide Openeye Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: 2-[(4-methyl-1,2,4-triazol-3-yl)thio]-N-[5-(4-morpholinylsulfonyl)-2-propan-2-yloxyphenyl]acetamide IUPAC Name: 2-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(5-morpholin-4-ylsulfonyl-2-propan-2-yloxyphenyl)acetamide Traditional Name: N-(2-isopropoxy-5-morpholinosulfonyl-phenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C18H25N5O5S2 MolecularWeight: 455.5516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSC3=NN=CN3C

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)NC(=O)CSC3=NN=CN3C

InChI

InChI=1S/C18H25N5O5S2/c1-13(2)28-16-5-4-14(30(25,26)23-6-8-27-9-7-23)10-15(16)20-17(24)11-29-18-21-19-12-22(18)3/h4-5,10,12-13H,6-9,11H2,1-3H3,(H,20,24)