N-[(6-imidazol-1-ylpyridin-3-yl)methyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-[(6-imidazol-1-ylpyridin-3-yl)methyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-[(6-imidazol-1-yl-3-pyridyl)methyl]-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-[[6-(1-imidazolyl)-3-pyridinyl]methyl]-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-[(6-imidazol-1-ylpyridin-3-yl)methyl]-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: (6-imidazol-1-yl-3-pyridyl)methyl-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C19H20N6O4S MolecularWeight: 428.4649

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)NCC3=CN=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O4S/c26-25(27)18-11-16(30(28,29)24-8-1-2-9-24)4-5-17(18)21-12-15-3-6-19(22-13-15)23-10-7-20-14-23/h3-7,10-11,13-14,21H,1-2,8-9,12H2