2-[[4-(3-chloranyl-4-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]quinoline

Systemtic Name: 2-[[4-(3-chloranyl-4-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]quinoline Openeye Name: 2-[[4-(3-chloro-4-methyl-phenyl)sulfonylpiperazin-1-yl]methyl]quinoline CAS Name: 2-[[4-(3-chloro-4-methylphenyl)sulfonyl-1-piperazinyl]methyl]quinoline IUPAC Name: 2-[[4-(3-chloro-4-methylphenyl)sulfonylpiperazin-1-yl]methyl]quinoline Traditional Name: 2-[[4-(3-chloro-4-methyl-phenyl)sulfonylpiperazino]methyl]quinoline Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4C=C3)Cl

InChI

InChI=1S/C21H22ClN3O2S/c1-16-6-9-19(14-20(16)22)28(26,27)25-12-10-24(11-13-25)15-18-8-7-17-4-2-3-5-21(17)23-18/h2-9,14H,10-13,15H2,1H3