1H-indol-5-yl N-[1-(3-fluoranylpyridin-4-yl)propylamino]-N-(3-methyl-3,4-dihydro-1H-isoquinolin-2-yl)carbamate

Systemtic Name: 1H-indol-5-yl N-[1-(3-fluoranylpyridin-4-yl)propylamino]-N-(3-methyl-3,4-dihydro-1H-isoquinolin-2-yl)carbamate Openeye Name: 1H-indol-5-yl N-[1-(3-fluoro-4-pyridyl)propylamino]-N-(3-methyl-3,4-dihydro-1H-isoquinolin-2-yl)carbamate CAS Name: N-[1-(3-fluoro-4-pyridinyl)propylamino]-N-(3-methyl-3,4-dihydro-1H-isoquinolin-2-yl)carbamic acid 1H-indol-5-yl ester IUPAC Name: 1H-indol-5-yl N-[1-(3-fluoropyridin-4-yl)propylamino]-N-(3-methyl-3,4-dihydro-1H-isoquinolin-2-yl)carbamate Traditional Name: N-[1-(3-fluoro-4-pyridyl)propylamino]-N-(3-methyl-3,4-dihydro-1H-isoquinolin-2-yl)carbamic acid 1H-indol-5-yl ester Formula: C27H28FN5O2 MolecularWeight: 473.541923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=NC=C1)F)NN(C(=O)OC2=CC3=C(C=C2)NC=C3)N4CC5=CC=CC=C5CC4C

Isomeric SMILES

CCC(C1=C(C=NC=C1)F)NN(C(=O)OC2=CC3=C(C=C2)NC=C3)N4CC5=CC=CC=C5CC4C

InChI

InChI=1S/C27H28FN5O2/c1-3-25(23-11-12-29-16-24(23)28)31-33(32-17-21-7-5-4-6-19(21)14-18(32)2)27(34)35-22-8-9-26-20(15-22)10-13-30-26/h4-13,15-16,18,25,30-31H,3,14,17H2,1-2H3