N-[2-(2-azanylethanoyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide

Systemtic Name: N-[2-(2-azanylethanoyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide Openeye Name: N-[2-(2-aminoacetyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]-2-(7-isoquinolylamino)pyridine-3-carboxamide CAS Name: N-[2-(2-amino-1-oxoethyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]-2-(7-isoquinolinylamino)-3-pyridinecarboxamide IUPAC Name: N-[2-(2-aminoacetyl)-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl]-2-(isoquinolin-7-ylamino)pyridine-3-carboxamide Traditional Name: N-(2-glycyl-4,4-dimethyl-1,3-dihydroisoquinolin-7-yl)-2-(7-isoquinolylamino)nicotinamide Formula: C28H28N6O2 MolecularWeight: 480.56092

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(CC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NC4=CC5=C(C=C4)C=CN=C5)C(=O)CN)C

Isomeric SMILES

CC1(CN(CC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NC4=CC5=C(C=C4)C=CN=C5)C(=O)CN)C

InChI

InChI=1S/C28H28N6O2/c1-28(2)17-34(25(35)14-29)16-20-13-22(7-8-24(20)28)33-27(36)23-4-3-10-31-26(23)32-21-6-5-18-9-11-30-15-19(18)12-21/h3-13,15H,14,16-17,29H2,1-2H3,(H,31,32)(H,33,36)