2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-morpholin-4-ylphenyl)ethanamide

Systemtic Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-morpholin-4-ylphenyl)ethanamide Openeye Name: 2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(2-morpholinophenyl)acetamide CAS Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-[2-(4-morpholinyl)phenyl]acetamide IUPAC Name: 2-[3-(4-methoxyphenyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-N-(2-morpholin-4-ylphenyl)acetamide Traditional Name: 2-[3-(4-methoxyphenyl)-5-thioxo-1H-1,2,4-triazol-4-yl]-N-(2-morpholinophenyl)acetamide Formula: C21H23N5O3S MolecularWeight: 425.50402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NC3=CC=CC=C3N4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NNC(=S)N2CC(=O)NC3=CC=CC=C3N4CCOCC4

InChI

InChI=1S/C21H23N5O3S/c1-28-16-8-6-15(7-9-16)20-23-24-21(30)26(20)14-19(27)22-17-4-2-3-5-18(17)25-10-12-29-13-11-25/h2-9H,10-14H2,1H3,(H,22,27)(H,24,30)