N-ethyl-4-[[(2Z)-2-(4-methylphenyl)sulfonyliminopyrimidin-1-yl]methyl]benzamide

Systemtic Name: N-ethyl-4-[[(2Z)-2-(4-methylphenyl)sulfonyliminopyrimidin-1-yl]methyl]benzamide Openeye Name: N-ethyl-4-[[(2Z)-2-(p-tolylsulfonylimino)pyrimidin-1-yl]methyl]benzamide CAS Name: N-ethyl-4-[[(2Z)-2-(4-methylphenyl)sulfonylimino-1-pyrimidinyl]methyl]benzamide IUPAC Name: N-ethyl-4-[[(2Z)-2-(4-methylphenyl)sulfonyliminopyrimidin-1-yl]methyl]benzamide Traditional Name: N-ethyl-4-[[(2Z)-2-tosyliminopyrimidin-1-yl]methyl]benzamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC=C(C=C1)CN2C=CC=NC2=NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCNC(=O)C1=CC=C(C=C1)CN\2C=CC=N/C2=N\S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N4O3S/c1-3-22-20(26)18-9-7-17(8-10-18)15-25-14-4-13-23-21(25)24-29(27,28)19-11-5-16(2)6-12-19/h4-14H,3,15H2,1-2H3,(H,22,26)/b24-21+