ethyl 4-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[3-methyl-1-(phenylmethyl)pyrazol-4-yl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(1-benzyl-3-methyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate CAS Name: 4-[[3-methyl-1-(phenylmethyl)-4-pyrazolyl]sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(1-benzyl-3-methylpyrazol-4-yl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(1-benzyl-3-methyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CN(N=C2C)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CN(N=C2C)CC3=CC=CC=C3

InChI

InChI=1S/C18H24N4O4S/c1-3-26-18(23)20-9-11-22(12-10-20)27(24,25)17-14-21(19-15(17)2)13-16-7-5-4-6-8-16/h4-8,14H,3,9-13H2,1-2H3