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

Systemtic Name: N-[3-(4-bromanyl-3-methyl-pyrazol-1-yl)propyl]-3-naphthalen-2-ylsulfonyl-propanamide Openeye Name: N-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(2-naphthylsulfonyl)propanamide CAS Name: N-[3-(4-bromo-3-methyl-1-pyrazolyl)propyl]-3-(2-naphthalenylsulfonyl)propanamide IUPAC Name: N-[3-(4-bromo-3-methylpyrazol-1-yl)propyl]-3-naphthalen-2-ylsulfonylpropanamide Traditional Name: N-[3-(4-bromo-3-methyl-pyrazol-1-yl)propyl]-3-(2-naphthylsulfonyl)propionamide Formula: C20H22BrN3O3S MolecularWeight: 464.37598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1Br)CCCNC(=O)CCS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=NN(C=C1Br)CCCNC(=O)CCS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H22BrN3O3S/c1-15-19(21)14-24(23-15)11-4-10-22-20(25)9-12-28(26,27)18-8-7-16-5-2-3-6-17(16)13-18/h2-3,5-8,13-14H,4,9-12H2,1H3,(H,22,25)