4-morpholin-4-ylsulfonyl-2-nitro-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]aniline

Systemtic Name: 4-morpholin-4-ylsulfonyl-2-nitro-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]aniline Openeye Name: 4-morpholinosulfonyl-2-nitro-N-[(2-pyrazol-1-yl-3-pyridyl)methyl]aniline CAS Name: 4-(4-morpholinylsulfonyl)-2-nitro-N-[[2-(1-pyrazolyl)-3-pyridinyl]methyl]aniline IUPAC Name: 4-morpholin-4-ylsulfonyl-2-nitro-N-[(2-pyrazol-1-ylpyridin-3-yl)methyl]aniline Traditional Name: (4-morpholinosulfonyl-2-nitro-phenyl)-[(2-pyrazol-1-yl-3-pyridyl)methyl]amine Formula: C19H20N6O5S MolecularWeight: 444.4643

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)NCC3=C(N=CC=C3)N4C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC(=C(C=C2)NCC3=C(N=CC=C3)N4C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O5S/c26-25(27)18-13-16(31(28,29)23-9-11-30-12-10-23)4-5-17(18)21-14-15-3-1-6-20-19(15)24-8-2-7-22-24/h1-8,13,21H,9-12,14H2