[4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone

Systemtic Name: [4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone Openeye Name: [4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone CAS Name: [4-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-1-piperazinyl]-[4-(1-pyrazolyl)phenyl]methanone IUPAC Name: [4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-(4-pyrazol-1-ylphenyl)methanone Traditional Name: [4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazino]-(4-pyrazol-1-ylphenyl)methanone Formula: C24H28N4O3S MolecularWeight: 452.56912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C24H28N4O3S/c1-3-19(2)20-7-11-23(12-8-20)32(30,31)27-17-15-26(16-18-27)24(29)21-5-9-22(10-6-21)28-14-4-13-25-28/h4-14,19H,3,15-18H2,1-2H3/t19-/m0/s1