N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide

Systemtic Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanamide Openeye Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide CAS Name: N-[4-(1-azepanylmethyl)-2-thiazolyl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide IUPAC Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)acetamide Traditional Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)acetamide Formula: C17H26N6OS2 MolecularWeight: 394.55794

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)NC2=NC(=CS2)CN3CCCCCC3

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)NC2=NC(=CS2)CN3CCCCCC3

InChI

InChI=1S/C17H26N6OS2/c1-2-7-14-20-21-17(25)23(14)11-15(24)19-16-18-13(12-26-16)10-22-8-5-3-4-6-9-22/h12H,2-11H2,1H3,(H,21,25)(H,18,19,24)