4-[[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]methyl]-N-methyl-benzamide

Systemtic Name: 4-[[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[[2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]acetyl]-methyl-amino]methyl]-N-methyl-benzamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N(C)CC2=CC=C(C=C2)C(=O)NC)C3=CC=CC=C3

InChI

InChI=1S/C22H25N5O2S/c1-4-27-20(17-8-6-5-7-9-17)24-25-22(27)30-15-19(28)26(3)14-16-10-12-18(13-11-16)21(29)23-2/h5-13H,4,14-15H2,1-3H3,(H,23,29)