2-(2-chloranylpyrimidin-4-yl)-6-methoxy-1-[[4-(1-piperidin-2-ylethoxy)phenyl]methyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(2-chloranylpyrimidin-4-yl)-6-methoxy-1-[[4-(1-piperidin-2-ylethoxy)phenyl]methyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(2-chloropyrimidin-4-yl)-6-methoxy-1-[[4-[1-(2-piperidyl)ethoxy]phenyl]methyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-(2-chloro-4-pyrimidinyl)-6-methoxy-1-[[4-[1-(2-piperidinyl)ethoxy]phenyl]methyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(2-chloropyrimidin-4-yl)-6-methoxy-1-[[4-(1-piperidin-2-ylethoxy)phenyl]methyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(2-chloropyrimidin-4-yl)-6-methoxy-1-[4-[1-(2-piperidyl)ethoxy]benzyl]-3,4-dihydro-1H-isoquinoline Formula: C28H33ClN4O2 MolecularWeight: 493.04022

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCN1)OC2=CC=C(C=C2)CC3C4=C(CCN3C5=NC(=NC=C5)Cl)C=C(C=C4)OC

Isomeric SMILES

CC(C1CCCCN1)OC2=CC=C(C=C2)CC3C4=C(CCN3C5=NC(=NC=C5)Cl)C=C(C=C4)OC

InChI

InChI=1S/C28H33ClN4O2/c1-19(25-5-3-4-14-30-25)35-22-8-6-20(7-9-22)17-26-24-11-10-23(34-2)18-21(24)13-16-33(26)27-12-15-31-28(29)32-27/h6-12,15,18-19,25-26,30H,3-5,13-14,16-17H2,1-2H3