N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[1-(3,4-dipropoxyphenyl)ethyl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C21H32N4O3S MolecularWeight: 420.56878

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NC(C)C2=CC(=C(C=C2)OCCC)OCCC

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NC(C)C2=CC(=C(C=C2)OCCC)OCCC

InChI

InChI=1S/C21H32N4O3S/c1-5-8-19-23-24-21(29)25(19)14-20(26)22-15(4)16-9-10-17(27-11-6-2)18(13-16)28-12-7-3/h9-10,13,15H,5-8,11-12,14H2,1-4H3,(H,22,26)(H,24,29)