[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: [3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-chloro-4-isobutoxy-5-methoxy-phenyl)-[4-[(5-methyl-2-thienyl)sulfonyl]piperazin-1-yl]methanone CAS Name: [3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]-[4-[(5-methyl-2-thiophenyl)sulfonyl]-1-piperazinyl]methanone IUPAC Name: [3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]-[4-(5-methylthiophen-2-yl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-chloro-4-isobutoxy-5-methoxy-phenyl)-[4-[(5-methyl-2-thienyl)sulfonyl]piperazino]methanone Formula: C21H27ClN2O5S2 MolecularWeight: 487.03248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)Cl)OCC(C)C)OC

Isomeric SMILES

CC1=CC=C(S1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C(=C3)Cl)OCC(C)C)OC

InChI

InChI=1S/C21H27ClN2O5S2/c1-14(2)13-29-20-17(22)11-16(12-18(20)28-4)21(25)23-7-9-24(10-8-23)31(26,27)19-6-5-15(3)30-19/h5-6,11-12,14H,7-10,13H2,1-4H3