2-[(3-chlorophenyl)amino]-4-ethyl-N-(oxan-4-ylmethyl)pyrimidine-5-carboxamide

Systemtic Name: 2-[(3-chlorophenyl)amino]-4-ethyl-N-(oxan-4-ylmethyl)pyrimidine-5-carboxamide Openeye Name: 2-(3-chloroanilino)-4-ethyl-N-(tetrahydropyran-4-ylmethyl)pyrimidine-5-carboxamide CAS Name: 2-(3-chloroanilino)-4-ethyl-N-(4-oxanylmethyl)-5-pyrimidinecarboxamide IUPAC Name: 2-(3-chloroanilino)-4-ethyl-N-(oxan-4-ylmethyl)pyrimidine-5-carboxamide Traditional Name: 2-(3-chloroanilino)-4-ethyl-N-(tetrahydropyran-4-ylmethyl)pyrimidine-5-carboxamide Formula: C19H23ClN4O2 MolecularWeight: 374.86452

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NC=C1C(=O)NCC2CCOCC2)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CCC1=NC(=NC=C1C(=O)NCC2CCOCC2)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H23ClN4O2/c1-2-17-16(18(25)21-11-13-6-8-26-9-7-13)12-22-19(24-17)23-15-5-3-4-14(20)10-15/h3-5,10,12-13H,2,6-9,11H2,1H3,(H,21,25)(H,22,23,24)