4-cyano-1-ethoxy-1-(1-pyridin-4-ylpiperidin-4-yl)-3,4-dihydroisoquinoline-2-carboximidamide

Systemtic Name: 4-cyano-1-ethoxy-1-(1-pyridin-4-ylpiperidin-4-yl)-3,4-dihydroisoquinoline-2-carboximidamide Openeye Name: 4-cyano-1-ethoxy-1-[1-(4-pyridyl)-4-piperidyl]-3,4-dihydroisoquinoline-2-carboxamidine CAS Name: 4-cyano-1-ethoxy-1-(1-pyridin-4-yl-4-piperidinyl)-3,4-dihydroisoquinoline-2-carboximidamide IUPAC Name: 4-cyano-1-ethoxy-1-(1-pyridin-4-ylpiperidin-4-yl)-3,4-dihydroisoquinoline-2-carboximidamide Traditional Name: 4-cyano-1-ethoxy-1-[1-(4-pyridyl)-4-piperidyl]-3,4-dihydroisoquinoline-2-carboxamidine Formula: C23H28N6O MolecularWeight: 404.50802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C2=CC=CC=C2C(CN1C(=N)N)C#N)C3CCN(CC3)C4=CC=NC=C4

Isomeric SMILES

CCOC1(C2=CC=CC=C2C(CN1C(=N)N)C#N)C3CCN(CC3)C4=CC=NC=C4

InChI

InChI=1S/C23H28N6O/c1-2-30-23(18-9-13-28(14-10-18)19-7-11-27-12-8-19)21-6-4-3-5-20(21)17(15-24)16-29(23)22(25)26/h3-8,11-12,17-18H,2,9-10,13-14,16H2,1H3,(H3,25,26)