(NE)-N-[azanyl-(3-methylphenyl)methylidene]-4-naphthalen-2-ylsulfonyl-piperazine-1-carboxamide

Systemtic Name: (NE)-N-[azanyl-(3-methylphenyl)methylidene]-4-naphthalen-2-ylsulfonyl-piperazine-1-carboxamide Openeye Name: (NE)-N-[amino(m-tolyl)methylene]-4-(2-naphthylsulfonyl)piperazine-1-carboxamide CAS Name: (NE)-N-[amino-(3-methylphenyl)methylidene]-4-(2-naphthalenylsulfonyl)-1-piperazinecarboxamide IUPAC Name: (NE)-N-[amino-(3-methylphenyl)methylidene]-4-naphthalen-2-ylsulfonylpiperazine-1-carboxamide Traditional Name: (NE)-N-[amino(m-tolyl)methylene]-4-(2-naphthylsulfonyl)piperazine-1-carboxamide Formula: C23H24N4O3S MolecularWeight: 436.52666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=NC(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)N

Isomeric SMILES

CC1=CC=CC(=C1)/C(=N\C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)/N

InChI

InChI=1S/C23H24N4O3S/c1-17-5-4-8-20(15-17)22(24)25-23(28)26-11-13-27(14-12-26)31(29,30)21-10-9-18-6-2-3-7-19(18)16-21/h2-10,15-16H,11-14H2,1H3,(H2,24,25,28)