N-[3-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]phenyl]-2-pyrazol-1-yl-propanamide

Systemtic Name: N-[3-[(4-chloranyl-3-nitro-phenyl)sulfonylamino]phenyl]-2-pyrazol-1-yl-propanamide Openeye Name: N-[3-[(4-chloro-3-nitro-phenyl)sulfonylamino]phenyl]-2-pyrazol-1-yl-propanamide CAS Name: N-[3-[(4-chloro-3-nitrophenyl)sulfonylamino]phenyl]-2-(1-pyrazolyl)propanamide IUPAC Name: N-[3-[(4-chloro-3-nitrophenyl)sulfonylamino]phenyl]-2-pyrazol-1-ylpropanamide Traditional Name: N-[3-[(4-chloro-3-nitro-phenyl)sulfonylamino]phenyl]-2-pyrazol-1-yl-propionamide Formula: C18H16ClN5O5S MolecularWeight: 449.86814

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])N3C=CC=N3

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])N3C=CC=N3

InChI

InChI=1S/C18H16ClN5O5S/c1-12(23-9-3-8-20-23)18(25)21-13-4-2-5-14(10-13)22-30(28,29)15-6-7-16(19)17(11-15)24(26)27/h2-12,22H,1H3,(H,21,25)