[4-(5-butylsulfonyl-1,3-thiazol-2-yl)piperazin-1-yl]-(5-methylsulfonyl-2-propan-2-yloxy-phenyl)methanone

Systemtic Name: [4-(5-butylsulfonyl-1,3-thiazol-2-yl)piperazin-1-yl]-(5-methylsulfonyl-2-propan-2-yloxy-phenyl)methanone Openeye Name: [4-(5-butylsulfonylthiazol-2-yl)piperazin-1-yl]-(2-isopropoxy-5-methylsulfonyl-phenyl)methanone CAS Name: [4-(5-butylsulfonyl-2-thiazolyl)-1-piperazinyl]-(5-methylsulfonyl-2-propan-2-yloxyphenyl)methanone IUPAC Name: [4-(5-butylsulfonyl-1,3-thiazol-2-yl)piperazin-1-yl]-(5-methylsulfonyl-2-propan-2-yloxyphenyl)methanone Traditional Name: [4-(5-butylsulfonylthiazol-2-yl)piperazino]-(2-isopropoxy-5-mesyl-phenyl)methanone Formula: C22H31N3O6S3 MolecularWeight: 529.69304

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=CN=C(S1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)OC(C)C

Isomeric SMILES

CCCCS(=O)(=O)C1=CN=C(S1)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)S(=O)(=O)C)OC(C)C

InChI

InChI=1S/C22H31N3O6S3/c1-5-6-13-34(29,30)20-15-23-22(32-20)25-11-9-24(10-12-25)21(26)18-14-17(33(4,27)28)7-8-19(18)31-16(2)3/h7-8,14-16H,5-6,9-13H2,1-4H3