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

Systemtic Name: [4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-(1-methylpyrazol-4-yl)methanone Openeye Name: [4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazin-1-yl]-(1-methylpyrazol-4-yl)methanone CAS Name: [4-[4-[(2S)-butan-2-yl]phenyl]sulfonyl-1-piperazinyl]-(1-methyl-4-pyrazolyl)methanone IUPAC Name: [4-[4-[(2S)-butan-2-yl]phenyl]sulfonylpiperazin-1-yl]-(1-methylpyrazol-4-yl)methanone Traditional Name: [4-[4-[(1S)-1-methylpropyl]phenyl]sulfonylpiperazino]-(1-methylpyrazol-4-yl)methanone Formula: C19H26N4O3S MolecularWeight: 390.49974

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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=CN(N=C3)C

Isomeric SMILES

CC[C@H](C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CN(N=C3)C

InChI

InChI=1S/C19H26N4O3S/c1-4-15(2)16-5-7-18(8-6-16)27(25,26)23-11-9-22(10-12-23)19(24)17-13-20-21(3)14-17/h5-8,13-15H,4,9-12H2,1-3H3/t15-/m0/s1