4-[1-azanyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-pyridin-4-yl-benzamide

Systemtic Name: 4-[1-azanyl-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-N-pyridin-4-yl-benzamide Openeye Name: 4-[1-amino-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]-N-(4-pyridyl)benzamide CAS Name: 4-[1-amino-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-pyridin-4-ylbenzamide IUPAC Name: 4-[1-amino-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-N-pyridin-4-ylbenzamide Traditional Name: 4-[1-amino-2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]-N-(4-pyridyl)benzamide Formula: C23H22N4O2 MolecularWeight: 386.44638

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)C(C3=CC=C(C=C3)C(=O)NC4=CC=NC=C4)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)C(C3=CC=C(C=C3)C(=O)NC4=CC=NC=C4)N

InChI

InChI=1S/C23H22N4O2/c24-21(23(29)27-14-11-16-3-1-2-4-19(16)15-27)17-5-7-18(8-6-17)22(28)26-20-9-12-25-13-10-20/h1-10,12-13,21H,11,14-15,24H2,(H,25,26,28)