3-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]-N-ethyl-benzamide

Systemtic Name: 3-[[1,3-bis(oxidanylidene)-2-pyridin-2-yl-isoquinolin-4-ylidene]methylamino]-N-ethyl-benzamide Openeye Name: 3-[[1,3-dioxo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]-N-ethyl-benzamide CAS Name: 3-[[1,3-dioxo-2-(2-pyridinyl)-4-isoquinolinylidene]methylamino]-N-ethylbenzamide IUPAC Name: 3-[(1,3-dioxo-2-pyridin-2-ylisoquinolin-4-ylidene)methylamino]-N-ethylbenzamide Traditional Name: 3-[[1,3-diketo-2-(2-pyridyl)-4-isoquinolylidene]methylamino]-N-ethyl-benzamide Formula: C24H20N4O3 MolecularWeight: 412.4406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=N4

InChI

InChI=1S/C24H20N4O3/c1-2-25-22(29)16-8-7-9-17(14-16)27-15-20-18-10-3-4-11-19(18)23(30)28(24(20)31)21-12-5-6-13-26-21/h3-15,27H,2H2,1H3,(H,25,29)