4-(4-propan-2-ylphenyl)sulfonyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]piperazine-1-carboxamide

Systemtic Name: 4-(4-propan-2-ylphenyl)sulfonyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]piperazine-1-carboxamide Openeye Name: 4-(4-isopropylphenyl)sulfonyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]piperazine-1-carboxamide CAS Name: 4-(4-propan-2-ylphenyl)sulfonyl-N-[2-[4-(1-pyrazolyl)phenyl]ethyl]-1-piperazinecarboxamide IUPAC Name: 4-(4-propan-2-ylphenyl)sulfonyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]piperazine-1-carboxamide Traditional Name: 4-p-cumenylsulfonyl-N-[2-(4-pyrazol-1-ylphenyl)ethyl]piperazine-1-carboxamide Formula: C25H31N5O3S MolecularWeight: 481.61034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)NCCC3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C25H31N5O3S/c1-20(2)22-6-10-24(11-7-22)34(32,33)29-18-16-28(17-19-29)25(31)26-14-12-21-4-8-23(9-5-21)30-15-3-13-27-30/h3-11,13,15,20H,12,14,16-19H2,1-2H3,(H,26,31)