ethyl 4-(3-phenyl-1-propan-2-yl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(3-phenyl-1-propan-2-yl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(1-isopropyl-3-phenyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylate CAS Name: 4-[(3-phenyl-1-propan-2-yl-4-pyrazolyl)sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-phenyl-1-propan-2-ylpyrazol-4-yl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(1-isopropyl-3-phenyl-pyrazol-4-yl)sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CN(N=C2C3=CC=CC=C3)C(C)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CN(N=C2C3=CC=CC=C3)C(C)C

InChI

InChI=1S/C19H26N4O4S/c1-4-27-19(24)21-10-12-22(13-11-21)28(25,26)17-14-23(15(2)3)20-18(17)16-8-6-5-7-9-16/h5-9,14-15H,4,10-13H2,1-3H3