3-(4-nitroimidazol-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 3-(4-nitroimidazol-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: 3-(4-nitroimidazol-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: 3-(4-nitro-1-imidazolyl)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: 3-(4-nitroimidazol-1-yl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: 3-(4-nitroimidazol-1-yl)-N-(3-pyrrolidinosulfonylphenyl)propionamide Formula: C16H19N5O5S MolecularWeight: 393.41756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCN3C=C(N=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCN3C=C(N=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O5S/c22-16(6-9-19-11-15(17-12-19)21(23)24)18-13-4-3-5-14(10-13)27(25,26)20-7-1-2-8-20/h3-5,10-12H,1-2,6-9H2,(H,18,22)