N-(2-ethylphenyl)-2-[4-[(4-pentyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[(4-pentyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[(4-pentyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[(4-pentyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[(4-pentyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl]piperazin-1-yl]acetamide Traditional Name: 2-[4-[(4-amyl-5-thioxo-1,2,4-triazol-1-yl)methyl]piperazino]-N-(2-ethylphenyl)acetamide Formula: C22H34N6OS MolecularWeight: 430.60996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C=NN(C1=S)CN2CCN(CC2)CC(=O)NC3=CC=CC=C3CC

Isomeric SMILES

CCCCCN1C=NN(C1=S)CN2CCN(CC2)CC(=O)NC3=CC=CC=C3CC

InChI

InChI=1S/C22H34N6OS/c1-3-5-8-11-27-17-23-28(22(27)30)18-26-14-12-25(13-15-26)16-21(29)24-20-10-7-6-9-19(20)4-2/h6-7,9-10,17H,3-5,8,11-16,18H2,1-2H3,(H,24,29)