1-[1-(3-chloranylphenoxy)propan-2-yl]-1-cyano-2-isoquinolin-5-yl-guanidine

Systemtic Name: 1-[1-(3-chloranylphenoxy)propan-2-yl]-1-cyano-2-isoquinolin-5-yl-guanidine Openeye Name: 1-[2-(3-chlorophenoxy)-1-methyl-ethyl]-1-cyano-2-(5-isoquinolyl)guanidine CAS Name: 1-[1-(3-chlorophenoxy)propan-2-yl]-1-cyano-2-(5-isoquinolinyl)guanidine IUPAC Name: 1-[1-(3-chlorophenoxy)propan-2-yl]-1-cyano-2-isoquinolin-5-ylguanidine Traditional Name: 1-[2-(3-chlorophenoxy)-1-methyl-ethyl]-1-cyano-2-(5-isoquinolyl)guanidine Formula: C20H18ClN5O MolecularWeight: 379.84282

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC(=CC=C1)Cl)N(C#N)C(=NC2=CC=CC3=C2C=CN=C3)N

Isomeric SMILES

CC(COC1=CC(=CC=C1)Cl)N(C#N)C(=NC2=CC=CC3=C2C=CN=C3)N

InChI

InChI=1S/C20H18ClN5O/c1-14(12-27-17-6-3-5-16(21)10-17)26(13-22)20(23)25-19-7-2-4-15-11-24-9-8-18(15)19/h2-11,14H,12H2,1H3,(H2,23,25)