4-methyl-3-nitro-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]benzenesulfonamide

Systemtic Name: 4-methyl-3-nitro-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]benzenesulfonamide Openeye Name: 4-methyl-3-nitro-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]benzenesulfonamide CAS Name: 4-methyl-3-nitro-N-[[2-(1-pyrazolyl)-4-pyridinyl]methyl]benzenesulfonamide IUPAC Name: 4-methyl-3-nitro-N-[(2-pyrazol-1-ylpyridin-4-yl)methyl]benzenesulfonamide Traditional Name: 4-methyl-3-nitro-N-[(2-pyrazol-1-yl-4-pyridyl)methyl]benzenesulfonamide Formula: C16H15N5O4S MolecularWeight: 373.3864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC(=NC=C2)N3C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC(=NC=C2)N3C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O4S/c1-12-3-4-14(10-15(12)21(22)23)26(24,25)19-11-13-5-7-17-16(9-13)20-8-2-6-18-20/h2-10,19H,11H2,1H3