[4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-[2-(2-methylpropoxy)-5-methylsulfonyl-phenyl]methanone

Systemtic Name: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-[2-(2-methylpropoxy)-5-methylsulfonyl-phenyl]methanone Openeye Name: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-(2-isobutoxy-5-methylsulfonyl-phenyl)methanone CAS Name: [4-(1,3-benzoxazol-2-yl)-1-piperazinyl]-[2-(2-methylpropoxy)-5-methylsulfonylphenyl]methanone IUPAC Name: [4-(1,3-benzoxazol-2-yl)piperazin-1-yl]-[2-(2-methylpropoxy)-5-methylsulfonylphenyl]methanone Traditional Name: [4-(1,3-benzoxazol-2-yl)piperazino]-(2-isobutoxy-5-mesyl-phenyl)methanone Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)S(=O)(=O)C)C(=O)N2CCN(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C23H27N3O5S/c1-16(2)15-30-20-9-8-17(32(3,28)29)14-18(20)22(27)25-10-12-26(13-11-25)23-24-19-6-4-5-7-21(19)31-23/h4-9,14,16H,10-13,15H2,1-3H3