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

Systemtic Name: N-(phenylmethyl)-2-[4-(phenylmethyl)phenyl]-2-(3-propan-2-ylsulfonylpiperazin-1-yl)ethanamine Openeye Name: N-benzyl-2-(4-benzylphenyl)-2-(3-isopropylsulfonylpiperazin-1-yl)ethanamine CAS Name: N-(phenylmethyl)-2-[4-(phenylmethyl)phenyl]-2-(3-propan-2-ylsulfonyl-1-piperazinyl)ethanamine IUPAC Name: N-benzyl-2-(4-benzylphenyl)-2-(3-propan-2-ylsulfonylpiperazin-1-yl)ethanamine Traditional Name: benzyl-[2-(4-benzylphenyl)-2-(3-isopropylsulfonylpiperazino)ethyl]amine Formula: C29H37N3O2S MolecularWeight: 491.68798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1CN(CCN1)C(CNCC2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)S(=O)(=O)C1CN(CCN1)C(CNCC2=CC=CC=C2)C3=CC=C(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C29H37N3O2S/c1-23(2)35(33,34)29-22-32(18-17-31-29)28(21-30-20-26-11-7-4-8-12-26)27-15-13-25(14-16-27)19-24-9-5-3-6-10-24/h3-16,23,28-31H,17-22H2,1-2H3