3-[[2-(isoquinolin-6-ylamino)-2-oxidanylidene-ethyl]amino]benzamide

Systemtic Name: 3-[[2-(isoquinolin-6-ylamino)-2-oxidanylidene-ethyl]amino]benzamide Openeye Name: 3-[[2-(6-isoquinolylamino)-2-oxo-ethyl]amino]benzamide CAS Name: 3-[[2-(6-isoquinolinylamino)-2-oxoethyl]amino]benzamide IUPAC Name: 3-[[2-(isoquinolin-6-ylamino)-2-oxoethyl]amino]benzamide Traditional Name: 3-[[2-(6-isoquinolylamino)-2-keto-ethyl]amino]benzamide Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NCC(=O)NC2=CC3=C(C=C2)C=NC=C3)C(=O)N

Isomeric SMILES

C1=CC(=CC(=C1)NCC(=O)NC2=CC3=C(C=C2)C=NC=C3)C(=O)N

InChI

InChI=1S/C18H16N4O2/c19-18(24)13-2-1-3-15(9-13)21-11-17(23)22-16-5-4-14-10-20-7-6-12(14)8-16/h1-10,21H,11H2,(H2,19,24)(H,22,23)