4-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-methyl-N-propyl-benzamide

Systemtic Name: 4-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-methyl-N-propyl-benzamide Openeye Name: 4-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-methyl-N-propyl-benzamide CAS Name: 4-[[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]-N-methyl-N-propylbenzamide IUPAC Name: 4-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-methyl-N-propylbenzamide Traditional Name: 4-[[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-N-methyl-N-propyl-benzamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C)C(=O)C1=CC=C(C=C1)CSC2=NN=C(N2CC)C3=CC=NC=C3

Isomeric SMILES

CCCN(C)C(=O)C1=CC=C(C=C1)CSC2=NN=C(N2CC)C3=CC=NC=C3

InChI

InChI=1S/C21H25N5OS/c1-4-14-25(3)20(27)18-8-6-16(7-9-18)15-28-21-24-23-19(26(21)5-2)17-10-12-22-13-11-17/h6-13H,4-5,14-15H2,1-3H3