N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide

Systemtic Name: N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Openeye Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]-N-[(E)-tetralin-1-ylideneamino]benzamide CAS Name: N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-[(E)-3,4-dihydro-2H-naphthalen-1-ylideneamino]-4-[(4-methyl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: 4-[[(4-methyl-1,2,4-triazol-3-yl)thio]methyl]-N-[(E)-tetralin-1-ylideneamino]benzamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SCC2=CC=C(C=C2)C(=O)NN=C3CCCC4=CC=CC=C43

Isomeric SMILES

CN1C=NN=C1SCC2=CC=C(C=C2)C(=O)N/N=C/3\CCCC4=CC=CC=C43

InChI

InChI=1S/C21H21N5OS/c1-26-14-22-25-21(26)28-13-15-9-11-17(12-10-15)20(27)24-23-19-8-4-6-16-5-2-3-7-18(16)19/h2-3,5,7,9-12,14H,4,6,8,13H2,1H3,(H,24,27)/b23-19+