N-[(E)-5-methylhexan-2-ylideneamino]-4-[[methyl-(4-methylphenyl)sulfonyl-amino]methyl]benzamide

Systemtic Name: N-[(E)-5-methylhexan-2-ylideneamino]-4-[[methyl-(4-methylphenyl)sulfonyl-amino]methyl]benzamide Openeye Name: N-[(E)-1,4-dimethylpentylideneamino]-4-[[methyl(p-tolylsulfonyl)amino]methyl]benzamide CAS Name: N-[(E)-5-methylhexan-2-ylideneamino]-4-[[methyl-(4-methylphenyl)sulfonylamino]methyl]benzamide IUPAC Name: N-[(E)-5-methylhexan-2-ylideneamino]-4-[[methyl-(4-methylphenyl)sulfonylamino]methyl]benzamide Traditional Name: N-[(E)-1,4-dimethylpentylideneamino]-4-[[methyl(tosyl)amino]methyl]benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)C(=O)NN=C(C)CCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)C(=O)N/N=C(\C)/CCC(C)C

InChI

InChI=1S/C23H31N3O3S/c1-17(2)6-9-19(4)24-25-23(27)21-12-10-20(11-13-21)16-26(5)30(28,29)22-14-7-18(3)8-15-22/h7-8,10-15,17H,6,9,16H2,1-5H3,(H,25,27)/b24-19+