N-(phenylmethyl)-2-(3-propan-2-ylsulfonylpiperazin-1-yl)-2-(4-propylphenyl)ethanamine

Systemtic Name: N-(phenylmethyl)-2-(3-propan-2-ylsulfonylpiperazin-1-yl)-2-(4-propylphenyl)ethanamine Openeye Name: N-benzyl-2-(3-isopropylsulfonylpiperazin-1-yl)-2-(4-propylphenyl)ethanamine CAS Name: N-(phenylmethyl)-2-(3-propan-2-ylsulfonyl-1-piperazinyl)-2-(4-propylphenyl)ethanamine IUPAC Name: N-benzyl-2-(3-propan-2-ylsulfonylpiperazin-1-yl)-2-(4-propylphenyl)ethanamine Traditional Name: benzyl-[2-(3-isopropylsulfonylpiperazino)-2-(4-propylphenyl)ethyl]amine Formula: C25H37N3O2S MolecularWeight: 443.64518

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)C(C)C

Isomeric SMILES

CCCC1=CC=C(C=C1)C(CNCC2=CC=CC=C2)N3CCNC(C3)S(=O)(=O)C(C)C

InChI

InChI=1S/C25H37N3O2S/c1-4-8-21-11-13-23(14-12-21)24(18-26-17-22-9-6-5-7-10-22)28-16-15-27-25(19-28)31(29,30)20(2)3/h5-7,9-14,20,24-27H,4,8,15-19H2,1-3H3