N-[(E)-5-methylhexan-2-ylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide

Systemtic Name: N-[(E)-5-methylhexan-2-ylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Openeye Name: N-[(E)-1,4-dimethylpentylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide CAS Name: N-[(E)-5-methylhexan-2-ylideneamino]-4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-[(E)-5-methylhexan-2-ylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: N-[(E)-1,4-dimethylpentylideneamino]-4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzamide Formula: C18H25N5OS MolecularWeight: 359.489

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=NNC(=O)C1=CC=C(C=C1)CSC2=NN=CN2C)C

Isomeric SMILES

CC(C)CC/C(=N/NC(=O)C1=CC=C(C=C1)CSC2=NN=CN2C)/C

InChI

InChI=1S/C18H25N5OS/c1-13(2)5-6-14(3)20-21-17(24)16-9-7-15(8-10-16)11-25-18-22-19-12-23(18)4/h7-10,12-13H,5-6,11H2,1-4H3,(H,21,24)/b20-14+