(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: (1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-[4-(2-naphthylsulfonyl)piperazin-1-yl]methanone CAS Name: (1-butyl-5-chloro-3-methyl-4-pyrazolyl)-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]methanone IUPAC Name: (1-butyl-5-chloro-3-methylpyrazol-4-yl)-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-[4-(2-naphthylsulfonyl)piperazino]methanone Formula: C23H27ClN4O3S MolecularWeight: 475.00348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)Cl

InChI

InChI=1S/C23H27ClN4O3S/c1-3-4-11-28-22(24)21(17(2)25-28)23(29)26-12-14-27(15-13-26)32(30,31)20-10-9-18-7-5-6-8-19(18)16-20/h5-10,16H,3-4,11-15H2,1-2H3