(4-methylpyrimidin-2-yl)-[4-(3-phenylpropanoylamino)phenyl]sulfonyl-azanide

Systemtic Name: (4-methylpyrimidin-2-yl)-[4-(3-phenylpropanoylamino)phenyl]sulfonyl-azanide Openeye Name: (4-methylpyrimidin-2-yl)-[4-(3-phenylpropanoylamino)phenyl]sulfonyl-azanide CAS Name: (4-methyl-2-pyrimidinyl)-[4-[(1-oxo-3-phenylpropyl)amino]phenyl]sulfonylazanide IUPAC Name: (4-methylpyrimidin-2-yl)-[4-(3-phenylpropanoylamino)phenyl]sulfonylazanide Traditional Name: [4-(hydrocinnamoylamino)phenyl]sulfonyl-(4-methylpyrimidin-2-yl)azanide Formula: C20H19N4O3S- MolecularWeight: 395.45486

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NC=C1)[N-]S(=O)(=O)C2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H20N4O3S/c1-15-13-14-21-20(22-15)24-28(26,27)18-10-8-17(9-11-18)23-19(25)12-7-16-5-3-2-4-6-16/h2-6,8-11,13-14H,7,12H2,1H3,(H2,21,22,23,24,25)/p-1