N-(cyclohexa-1,3-dien-1-ylmethyl)-2-(pyrimidin-2-ylamino)benzamide

Systemtic Name: N-(cyclohexa-1,3-dien-1-ylmethyl)-2-(pyrimidin-2-ylamino)benzamide Openeye Name: N-(cyclohexa-1,3-dien-1-ylmethyl)-2-(pyrimidin-2-ylamino)benzamide CAS Name: N-(1-cyclohexa-1,3-dienylmethyl)-2-(2-pyrimidinylamino)benzamide IUPAC Name: N-(cyclohexa-1,3-dien-1-ylmethyl)-2-(pyrimidin-2-ylamino)benzamide Traditional Name: N-(cyclohexa-1,3-dien-1-ylmethyl)-2-(2-pyrimidylamino)benzamide Formula: C18H18N4O MolecularWeight: 306.36172

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC=C1)CNC(=O)C2=CC=CC=C2NC3=NC=CC=N3

Isomeric SMILES

C1CC(=CC=C1)CNC(=O)C2=CC=CC=C2NC3=NC=CC=N3

InChI

InChI=1S/C18H18N4O/c23-17(21-13-14-7-2-1-3-8-14)15-9-4-5-10-16(15)22-18-19-11-6-12-20-18/h1-2,4-7,9-12H,3,8,13H2,(H,21,23)(H,19,20,22)