(NE)-N-[azanyl(phenyl)methylidene]-4-(2-methoxy-5-methyl-phenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: (NE)-N-[azanyl(phenyl)methylidene]-4-(2-methoxy-5-methyl-phenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: (NE)-N-[amino(phenyl)methylene]-4-(2-methoxy-5-methyl-phenyl)sulfonyl-piperazine-1-carboxamide CAS Name: (NE)-N-[amino(phenyl)methylidene]-4-(2-methoxy-5-methylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: (NE)-N-[amino(phenyl)methylidene]-4-(2-methoxy-5-methylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: (NE)-N-[amino(phenyl)methylene]-4-(2-methoxy-5-methyl-phenyl)sulfonyl-piperazine-1-carboxamide Formula: C20H24N4O4S MolecularWeight: 416.49396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)N=C(C3=CC=CC=C3)N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)/N=C(\C3=CC=CC=C3)/N

InChI

InChI=1S/C20H24N4O4S/c1-15-8-9-17(28-2)18(14-15)29(26,27)24-12-10-23(11-13-24)20(25)22-19(21)16-6-4-3-5-7-16/h3-9,14H,10-13H2,1-2H3,(H2,21,22,25)