2-(4-methylphenoxy)-N-[3-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)propyl]ethanamide

Systemtic Name: 2-(4-methylphenoxy)-N-[3-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)propyl]ethanamide Openeye Name: 2-(4-methylphenoxy)-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]acetamide CAS Name: 2-(4-methylphenoxy)-N-[3-[4-[oxo(thiomorpholin-4-yl)methyl]-1-triazolyl]propyl]acetamide IUPAC Name: 2-(4-methylphenoxy)-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]acetamide Traditional Name: 2-(4-methylphenoxy)-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]acetamide Formula: C19H25N5O3S MolecularWeight: 403.4985

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(=O)NCCCN2C=C(N=N2)C(=O)N3CCSCC3

Isomeric SMILES

CC1=CC=C(C=C1)OCC(=O)NCCCN2C=C(N=N2)C(=O)N3CCSCC3

InChI

InChI=1S/C19H25N5O3S/c1-15-3-5-16(6-4-15)27-14-18(25)20-7-2-8-24-13-17(21-22-24)19(26)23-9-11-28-12-10-23/h3-6,13H,2,7-12,14H2,1H3,(H,20,25)