2-azanyl-4-methyl-6-propan-2-yl-cyclohepta[d]pyrimidin-9-one

Systemtic Name: 2-azanyl-4-methyl-6-propan-2-yl-cyclohepta[d]pyrimidin-9-one Openeye Name: 2-amino-6-isopropyl-4-methyl-cyclohepta[d]pyrimidin-9-one CAS Name: 2-amino-4-methyl-6-propan-2-yl-9-cyclohepta[d]pyrimidinone IUPAC Name: 2-amino-4-methyl-6-propan-2-ylcyclohepta[d]pyrimidin-9-one Traditional Name: 2-amino-6-isopropyl-4-methyl-cyclohepta[d]pyrimidin-9-one Formula: C13H15N3O MolecularWeight: 229.2777

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=C1C=C(C=CC2=O)C(C)C)N

Isomeric SMILES

CC1=NC(=NC2=C1C=C(C=CC2=O)C(C)C)N

InChI

InChI=1S/C13H15N3O/c1-7(2)9-4-5-11(17)12-10(6-9)8(3)15-13(14)16-12/h4-7H,1-3H3,(H2,14,15,16)