(4-phenylpiperazin-1-yl)-[1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]methanone

Systemtic Name: (4-phenylpiperazin-1-yl)-[1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]methanone Openeye Name: (4-phenylpiperazin-1-yl)-[1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-3-piperidyl]methanone CAS Name: (4-phenyl-1-piperazinyl)-[1-[(1,3,5-trimethyl-4-pyrazolyl)sulfonyl]-3-piperidinyl]methanone IUPAC Name: (4-phenylpiperazin-1-yl)-[1-(1,3,5-trimethylpyrazol-4-yl)sulfonylpiperidin-3-yl]methanone Traditional Name: (4-phenylpiperazino)-[1-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-3-piperidyl]methanone Formula: C22H31N5O3S MolecularWeight: 445.57824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCCC(C2)C(=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H31N5O3S/c1-17-21(18(2)24(3)23-17)31(29,30)27-11-7-8-19(16-27)22(28)26-14-12-25(13-15-26)20-9-5-4-6-10-20/h4-6,9-10,19H,7-8,11-16H2,1-3H3