N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-5-pyrrolidin-1-ylsulfonyl-pyridin-2-amine

Systemtic Name: N-[2-[4-(phenylmethyl)piperazin-1-yl]ethyl]-5-pyrrolidin-1-ylsulfonyl-pyridin-2-amine Openeye Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-5-pyrrolidin-1-ylsulfonyl-pyridin-2-amine CAS Name: N-[2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-5-(1-pyrrolidinylsulfonyl)-2-pyridinamine IUPAC Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-5-pyrrolidin-1-ylsulfonylpyridin-2-amine Traditional Name: 2-(4-benzylpiperazino)ethyl-(5-pyrrolidinosulfonyl-2-pyridyl)amine Formula: C22H31N5O2S MolecularWeight: 429.57884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)NCCN3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CN=C(C=C2)NCCN3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H31N5O2S/c28-30(29,27-11-4-5-12-27)21-8-9-22(24-18-21)23-10-13-25-14-16-26(17-15-25)19-20-6-2-1-3-7-20/h1-3,6-9,18H,4-5,10-17,19H2,(H,23,24)