N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanesulfonamide

Systemtic Name: N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanesulfonamide Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-indolin-1-ylpropyl)ethanesulfonamide CAS Name: N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)ethanesulfonamide IUPAC Name: N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(3,5-dimethyl-4-nitropyrazol-1-yl)ethanesulfonamide Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(3-indolin-1-ylpropyl)ethanesulfonamide Formula: C18H25N5O4S MolecularWeight: 407.4872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCS(=O)(=O)NCCCN2CCC3=CC=CC=C32)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCS(=O)(=O)NCCCN2CCC3=CC=CC=C32)C)[N+](=O)[O-]

InChI

InChI=1S/C18H25N5O4S/c1-14-18(23(24)25)15(2)22(20-14)12-13-28(26,27)19-9-5-10-21-11-8-16-6-3-4-7-17(16)21/h3-4,6-7,19H,5,8-13H2,1-2H3