ethyl 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate CAS Name: 4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,5-dimethyl-1-phenylpyrazol-4-yl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(3,5-dimethyl-1-phenyl-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=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O4S/c1-4-26-18(23)20-10-12-21(13-11-20)27(24,25)17-14(2)19-22(15(17)3)16-8-6-5-7-9-16/h5-9H,4,10-13H2,1-3H3