[6-[2-[4-(phenylmethyl)piperazin-1-yl]ethylamino]pyridin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [6-[2-[4-(phenylmethyl)piperazin-1-yl]ethylamino]pyridin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [6-[2-(4-benzylpiperazin-1-yl)ethylamino]-3-pyridyl]-pyrrolidin-1-yl-methanone CAS Name: [6-[2-[4-(phenylmethyl)-1-piperazinyl]ethylamino]-3-pyridinyl]-(1-pyrrolidinyl)methanone IUPAC Name: [6-[2-(4-benzylpiperazin-1-yl)ethylamino]pyridin-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [6-[2-(4-benzylpiperazino)ethylamino]-3-pyridyl]-pyrrolidino-methanone Formula: C23H31N5O MolecularWeight: 393.52514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N5O/c29-23(28-11-4-5-12-28)21-8-9-22(25-18-21)24-10-13-26-14-16-27(17-15-26)19-20-6-2-1-3-7-20/h1-3,6-9,18H,4-5,10-17,19H2,(H,24,25)