N-methoxy-2-[3-(phenylmethyl)piperazin-1-yl]-2-(4-propan-2-ylsulfonylphenyl)ethanamine

Systemtic Name: N-methoxy-2-[3-(phenylmethyl)piperazin-1-yl]-2-(4-propan-2-ylsulfonylphenyl)ethanamine Openeye Name: 2-(3-benzylpiperazin-1-yl)-2-(4-isopropylsulfonylphenyl)-N-methoxy-ethanamine CAS Name: N-methoxy-2-[3-(phenylmethyl)-1-piperazinyl]-2-(4-propan-2-ylsulfonylphenyl)ethanamine IUPAC Name: 2-(3-benzylpiperazin-1-yl)-N-methoxy-2-(4-propan-2-ylsulfonylphenyl)ethanamine Traditional Name: [2-(3-benzylpiperazino)-2-(4-isopropylsulfonylphenyl)ethyl]-methoxy-amine Formula: C23H33N3O3S MolecularWeight: 431.59142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(CNOC)N2CCNC(C2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)S(=O)(=O)C1=CC=C(C=C1)C(CNOC)N2CCNC(C2)CC3=CC=CC=C3

InChI

InChI=1S/C23H33N3O3S/c1-18(2)30(27,28)22-11-9-20(10-12-22)23(16-25-29-3)26-14-13-24-21(17-26)15-19-7-5-4-6-8-19/h4-12,18,21,23-25H,13-17H2,1-3H3