N-[4-(2-azanylidenepyrrolidin-1-yl)phenyl]-2-(1-azanylisoquinolin-7-yl)oxy-4-methyl-pentanamide

Systemtic Name: N-[4-(2-azanylidenepyrrolidin-1-yl)phenyl]-2-(1-azanylisoquinolin-7-yl)oxy-4-methyl-pentanamide Openeye Name: 2-[(1-amino-7-isoquinolyl)oxy]-N-[4-(2-iminopyrrolidin-1-yl)phenyl]-4-methyl-pentanamide CAS Name: 2-[(1-amino-7-isoquinolinyl)oxy]-N-[4-(2-imino-1-pyrrolidinyl)phenyl]-4-methylpentanamide IUPAC Name: 2-(1-aminoisoquinolin-7-yl)oxy-N-[4-(2-iminopyrrolidin-1-yl)phenyl]-4-methylpentanamide Traditional Name: 2-[(1-amino-7-isoquinolyl)oxy]-N-[4-(2-iminopyrrolidino)phenyl]-4-methyl-valeramide Formula: C25H29N5O2 MolecularWeight: 431.53006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)N2CCCC2=N)OC3=CC4=C(C=C3)C=CN=C4N

Isomeric SMILES

CC(C)CC(C(=O)NC1=CC=C(C=C1)N2CCCC2=N)OC3=CC4=C(C=C3)C=CN=C4N

InChI

InChI=1S/C25H29N5O2/c1-16(2)14-22(32-20-10-5-17-11-12-28-24(27)21(17)15-20)25(31)29-18-6-8-19(9-7-18)30-13-3-4-23(30)26/h5-12,15-16,22,26H,3-4,13-14H2,1-2H3,(H2,27,28)(H,29,31)