3-[(5-chloranyl-2-methoxy-pyrimidin-4-yl)-propan-2-yl-amino]-N-cyano-N'-(3,5-dimethylphenyl)azetidine-1-carboximidamide

Systemtic Name: 3-[(5-chloranyl-2-methoxy-pyrimidin-4-yl)-propan-2-yl-amino]-N-cyano-N'-(3,5-dimethylphenyl)azetidine-1-carboximidamide Openeye Name: 3-[(5-chloro-2-methoxy-pyrimidin-4-yl)-isopropyl-amino]-N-cyano-N'-(3,5-dimethylphenyl)azetidine-1-carboxamidine CAS Name: 3-[(5-chloro-2-methoxy-4-pyrimidinyl)-propan-2-ylamino]-N-cyano-N'-(3,5-dimethylphenyl)-1-azetidinecarboximidamide IUPAC Name: 3-[(5-chloro-2-methoxypyrimidin-4-yl)-propan-2-ylamino]-N-cyano-N'-(3,5-dimethylphenyl)azetidine-1-carboximidamide Traditional Name: 3-[(5-chloro-2-methoxy-pyrimidin-4-yl)-isopropyl-amino]-N-cyano-N'-(3,5-dimethylphenyl)azetidine-1-carboxamidine Formula: C21H26ClN7O MolecularWeight: 427.93044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N=C(NC#N)N2CC(C2)N(C3=NC(=NC=C3Cl)OC)C(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)N=C(NC#N)N2CC(C2)N(C3=NC(=NC=C3Cl)OC)C(C)C)C

InChI

InChI=1S/C21H26ClN7O/c1-13(2)29(19-18(22)9-24-21(27-19)30-5)17-10-28(11-17)20(25-12-23)26-16-7-14(3)6-15(4)8-16/h6-9,13,17H,10-11H2,1-5H3,(H,25,26)