(NE)-N-[azanyl-(3-methylphenyl)methylidene]-4-(4-propylphenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: (NE)-N-[azanyl-(3-methylphenyl)methylidene]-4-(4-propylphenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: (NE)-N-[amino(m-tolyl)methylene]-4-(4-propylphenyl)sulfonyl-piperazine-1-carboxamide CAS Name: (NE)-N-[amino-(3-methylphenyl)methylidene]-4-(4-propylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: (NE)-N-[amino-(3-methylphenyl)methylidene]-4-(4-propylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: (NE)-N-[amino(m-tolyl)methylene]-4-(4-propylphenyl)sulfonyl-piperazine-1-carboxamide Formula: C22H28N4O3S MolecularWeight: 428.54772

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N=C(C3=CC(=CC=C3)C)N

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)/N=C(\C3=CC(=CC=C3)C)/N

InChI

InChI=1S/C22H28N4O3S/c1-3-5-18-8-10-20(11-9-18)30(28,29)26-14-12-25(13-15-26)22(27)24-21(23)19-7-4-6-17(2)16-19/h4,6-11,16H,3,5,12-15H2,1-2H3,(H2,23,24,27)