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

Systemtic Name: 4-[[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-amino]methyl]-N-methyl-benzamide Openeye Name: 4-[[(4-ethyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]methyl]-N-methyl-benzamide CAS Name: 4-[[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methylamino]methyl]-N-methylbenzamide IUPAC Name: 4-[[(4-ethyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methylamino]methyl]-N-methylbenzamide Traditional Name: 4-[[(4-ethyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-amino]methyl]-N-methyl-benzamide Formula: C21H25N5OS MolecularWeight: 395.5211

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)C(=O)NC)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=NN(C1=S)CN(C)CC2=CC=C(C=C2)C(=O)NC)C3=CC=CC=C3

InChI

InChI=1S/C21H25N5OS/c1-4-25-19(17-8-6-5-7-9-17)23-26(21(25)28)15-24(3)14-16-10-12-18(13-11-16)20(27)22-2/h5-13H,4,14-15H2,1-3H3,(H,22,27)