N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-ethoxy-3-methoxy-benzamide

Systemtic Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-ethoxy-3-methoxy-benzamide Openeye Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-ethoxy-3-methoxy-benzamide CAS Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-ethoxy-3-methoxybenzamide IUPAC Name: N-[3-(4-cyclopentyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propyl]-4-ethoxy-3-methoxybenzamide Traditional Name: N-[3-[4-cyclopentyl-5-(methylthio)-1,2,4-triazol-3-yl]propyl]-4-ethoxy-3-methoxy-benzamide Formula: C21H30N4O3S MolecularWeight: 418.5529

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NCCCC2=NN=C(N2C3CCCC3)SC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NCCCC2=NN=C(N2C3CCCC3)SC)OC

InChI

InChI=1S/C21H30N4O3S/c1-4-28-17-12-11-15(14-18(17)27-2)20(26)22-13-7-10-19-23-24-21(29-3)25(19)16-8-5-6-9-16/h11-12,14,16H,4-10,13H2,1-3H3,(H,22,26)