N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-naphthalen-2-ylsulfonyl-propanamide

Systemtic Name: N-[3-(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)propyl]-3-naphthalen-2-ylsulfonyl-propanamide Openeye Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(2-naphthylsulfonyl)propanamide CAS Name: N-[3-(4-bromo-3,5-dimethyl-1-pyrazolyl)propyl]-3-(2-naphthalenylsulfonyl)propanamide IUPAC Name: N-[3-(4-bromo-3,5-dimethylpyrazol-1-yl)propyl]-3-naphthalen-2-ylsulfonylpropanamide Traditional Name: N-[3-(4-bromo-3,5-dimethyl-pyrazol-1-yl)propyl]-3-(2-naphthylsulfonyl)propionamide Formula: C21H24BrN3O3S MolecularWeight: 478.40256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCNC(=O)CCS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C)Br

Isomeric SMILES

CC1=C(C(=NN1CCCNC(=O)CCS(=O)(=O)C2=CC3=CC=CC=C3C=C2)C)Br

InChI

InChI=1S/C21H24BrN3O3S/c1-15-21(22)16(2)25(24-15)12-5-11-23-20(26)10-13-29(27,28)19-9-8-17-6-3-4-7-18(17)14-19/h3-4,6-9,14H,5,10-13H2,1-2H3,(H,23,26)