1-(3-chloranyl-4-methyl-phenyl)-4-(2-methyl-5-propan-2-yl-phenyl)sulfonyl-piperazine

Systemtic Name: 1-(3-chloranyl-4-methyl-phenyl)-4-(2-methyl-5-propan-2-yl-phenyl)sulfonyl-piperazine Openeye Name: 1-(3-chloro-4-methyl-phenyl)-4-(5-isopropyl-2-methyl-phenyl)sulfonyl-piperazine CAS Name: 1-(3-chloro-4-methylphenyl)-4-(2-methyl-5-propan-2-ylphenyl)sulfonylpiperazine IUPAC Name: 1-(3-chloro-4-methylphenyl)-4-(2-methyl-5-propan-2-ylphenyl)sulfonylpiperazine Traditional Name: 1-(3-chloro-4-methyl-phenyl)-4-(5-isopropyl-2-methyl-phenyl)sulfonyl-piperazine Formula: C21H27ClN2O2S MolecularWeight: 406.96928

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27ClN2O2S/c1-15(2)18-7-5-17(4)21(13-18)27(25,26)24-11-9-23(10-12-24)19-8-6-16(3)20(22)14-19/h5-8,13-15H,9-12H2,1-4H3