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

Systemtic Name: (1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: (1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: (1-butyl-5-chloro-3-methyl-4-pyrazolyl)-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: (1-butyl-5-chloro-3-methylpyrazol-4-yl)-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: (1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C17H23ClN4O3S2 MolecularWeight: 430.97252

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CS3)Cl

InChI

InChI=1S/C17H23ClN4O3S2/c1-3-4-7-22-16(18)15(13(2)19-22)17(23)20-8-10-21(11-9-20)27(24,25)14-6-5-12-26-14/h5-6,12H,3-4,7-11H2,1-2H3