3-[[4-[2-[(3-chlorophenyl)amino]pyrimidin-4-yl]pyridin-2-yl]amino]propanimidamide

Systemtic Name: 3-[[4-[2-[(3-chlorophenyl)amino]pyrimidin-4-yl]pyridin-2-yl]amino]propanimidamide Openeye Name: 3-[[4-[2-(3-chloroanilino)pyrimidin-4-yl]-2-pyridyl]amino]propanamidine CAS Name: 3-[[4-[2-(3-chloroanilino)-4-pyrimidinyl]-2-pyridinyl]amino]propanimidamide IUPAC Name: 3-[[4-[2-(3-chloroanilino)pyrimidin-4-yl]pyridin-2-yl]amino]propanimidamide Traditional Name: 3-[[4-[2-(3-chloroanilino)pyrimidin-4-yl]-2-pyridyl]amino]propionamidine Formula: C18H18ClN7 MolecularWeight: 367.83542

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC2=NC=CC(=N2)C3=CC(=NC=C3)NCCC(=N)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC2=NC=CC(=N2)C3=CC(=NC=C3)NCCC(=N)N

InChI

InChI=1S/C18H18ClN7/c19-13-2-1-3-14(11-13)25-18-24-8-5-15(26-18)12-4-7-22-17(10-12)23-9-6-16(20)21/h1-5,7-8,10-11H,6,9H2,(H3,20,21)(H,22,23)(H,24,25,26)