2-[[2-[ethyl-[1-(phenylmethyl)piperidin-4-yl]amino]pyridin-3-yl]amino]-2-methyl-propanenitrile

Systemtic Name: 2-[[2-[ethyl-[1-(phenylmethyl)piperidin-4-yl]amino]pyridin-3-yl]amino]-2-methyl-propanenitrile Openeye Name: 2-[[2-[(1-benzyl-4-piperidyl)-ethyl-amino]-3-pyridyl]amino]-2-methyl-propanenitrile CAS Name: 2-[[2-[ethyl-[1-(phenylmethyl)-4-piperidinyl]amino]-3-pyridinyl]amino]-2-methylpropanenitrile IUPAC Name: 2-[[2-[(1-benzylpiperidin-4-yl)-ethylamino]pyridin-3-yl]amino]-2-methylpropanenitrile Traditional Name: 2-[[2-[(1-benzyl-4-piperidyl)-ethyl-amino]-3-pyridyl]amino]-2-methyl-propionitrile Formula: C23H31N5 MolecularWeight: 377.52574

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)CC2=CC=CC=C2)C3=C(C=CC=N3)NC(C)(C)C#N

Isomeric SMILES

CCN(C1CCN(CC1)CC2=CC=CC=C2)C3=C(C=CC=N3)NC(C)(C)C#N

InChI

InChI=1S/C23H31N5/c1-4-28(22-21(11-8-14-25-22)26-23(2,3)18-24)20-12-15-27(16-13-20)17-19-9-6-5-7-10-19/h5-11,14,20,26H,4,12-13,15-17H2,1-3H3