1,2-benzothiazol-3-yl-[4-[4-(2-methylpropyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: 1,2-benzothiazol-3-yl-[4-[4-(2-methylpropyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: 1,2-benzothiazol-3-yl-[4-(4-isobutylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: 1,2-benzothiazol-3-yl-[4-[4-(2-methylpropyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: 1,2-benzothiazol-3-yl-[4-[4-(2-methylpropyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: 1,2-benzothiazol-3-yl-[4-(4-isobutylphenyl)sulfonylpiperazino]methanone Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NSC4=CC=CC=C43

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NSC4=CC=CC=C43

InChI

InChI=1S/C22H25N3O3S2/c1-16(2)15-17-7-9-18(10-8-17)30(27,28)25-13-11-24(12-14-25)22(26)21-19-5-3-4-6-20(19)29-23-21/h3-10,16H,11-15H2,1-2H3