5-chloranyl-N-(4-methylphenyl)-2-(pyridin-3-ylmethylamino)pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-(4-methylphenyl)-2-(pyridin-3-ylmethylamino)pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-(p-tolyl)-2-(3-pyridylmethylamino)pyrimidine-4-carboxamide CAS Name: 5-chloro-N-(4-methylphenyl)-2-(3-pyridinylmethylamino)-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-(4-methylphenyl)-2-(pyridin-3-ylmethylamino)pyrimidine-4-carboxamide Traditional Name: 5-chloro-N-(p-tolyl)-2-(3-pyridylmethylamino)pyrimidine-4-carboxamide Formula: C18H16ClN5O MolecularWeight: 353.80554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)NCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2Cl)NCC3=CN=CC=C3

InChI

InChI=1S/C18H16ClN5O/c1-12-4-6-14(7-5-12)23-17(25)16-15(19)11-22-18(24-16)21-10-13-3-2-8-20-9-13/h2-9,11H,10H2,1H3,(H,23,25)(H,21,22,24)