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

Systemtic Name: 3-[[2-(isoquinolin-6-ylamino)-2-oxidanylidene-ethyl]amino]-N-methyl-benzamide Openeye Name: 3-[[2-(6-isoquinolylamino)-2-oxo-ethyl]amino]-N-methyl-benzamide CAS Name: 3-[[2-(6-isoquinolinylamino)-2-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 3-[[2-(isoquinolin-6-ylamino)-2-oxoethyl]amino]-N-methylbenzamide Traditional Name: 3-[[2-(6-isoquinolylamino)-2-keto-ethyl]amino]-N-methyl-benzamide Formula: C19H18N4O2 MolecularWeight: 334.37182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O2/c1-20-19(25)14-3-2-4-16(10-14)22-12-18(24)23-17-6-5-15-11-21-8-7-13(15)9-17/h2-11,22H,12H2,1H3,(H,20,25)(H,23,24)