N-[(E)-(1-methylpyrazol-4-yl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline

Systemtic Name: N-[(E)-(1-methylpyrazol-4-yl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitro-aniline Openeye Name: N-[(E)-(1-methylpyrazol-4-yl)methyleneamino]-4-morpholinosulfonyl-2-nitro-aniline CAS Name: N-[(E)-(1-methyl-4-pyrazolyl)methylideneamino]-4-(4-morpholinylsulfonyl)-2-nitroaniline IUPAC Name: N-[(E)-(1-methylpyrazol-4-yl)methylideneamino]-4-morpholin-4-ylsulfonyl-2-nitroaniline Traditional Name: [(E)-(1-methylpyrazol-4-yl)methyleneamino]-(4-morpholinosulfonyl-2-nitro-phenyl)amine Formula: C15H18N6O5S MolecularWeight: 394.40562

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=NNC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=N1)/C=N/NC2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C15H18N6O5S/c1-19-11-12(10-17-19)9-16-18-14-3-2-13(8-15(14)21(22)23)27(24,25)20-4-6-26-7-5-20/h2-3,8-11,18H,4-7H2,1H3/b16-9+