N-ethoxy-2-[4-(2-methylpropyl)phenyl]-2-(3-propan-2-ylsulfonylpiperazin-1-yl)ethanamine

Systemtic Name: N-ethoxy-2-[4-(2-methylpropyl)phenyl]-2-(3-propan-2-ylsulfonylpiperazin-1-yl)ethanamine Openeye Name: N-ethoxy-2-(4-isobutylphenyl)-2-(3-isopropylsulfonylpiperazin-1-yl)ethanamine CAS Name: N-ethoxy-2-[4-(2-methylpropyl)phenyl]-2-(3-propan-2-ylsulfonyl-1-piperazinyl)ethanamine IUPAC Name: N-ethoxy-2-[4-(2-methylpropyl)phenyl]-2-(3-propan-2-ylsulfonylpiperazin-1-yl)ethanamine Traditional Name: ethoxy-[2-(4-isobutylphenyl)-2-(3-isopropylsulfonylpiperazino)ethyl]amine Formula: C21H37N3O3S MolecularWeight: 411.60178

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Descriptors Computed from Structure

Canonical SMILES:

CCONCC(C1=CC=C(C=C1)CC(C)C)N2CCNC(C2)S(=O)(=O)C(C)C

Isomeric SMILES

CCONCC(C1=CC=C(C=C1)CC(C)C)N2CCNC(C2)S(=O)(=O)C(C)C

InChI

InChI=1S/C21H37N3O3S/c1-6-27-23-14-20(19-9-7-18(8-10-19)13-16(2)3)24-12-11-22-21(15-24)28(25,26)17(4)5/h7-10,16-17,20-23H,6,11-15H2,1-5H3