ethyl 4-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepan-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[4-(2,6-dimethyl-5-propan-2-yl-pyrimidin-4-yl)-1,4-diazepan-1-yl]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]-4-oxo-butanoate CAS Name: 4-[4-(2,6-dimethyl-5-propan-2-yl-4-pyrimidinyl)-1,4-diazepan-1-yl]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[4-(2,6-dimethyl-5-propan-2-ylpyrimidin-4-yl)-1,4-diazepan-1-yl]-4-oxobutanoate Traditional Name: 4-[4-(5-isopropyl-2,6-dimethyl-pyrimidin-4-yl)-1,4-diazepan-1-yl]-4-keto-butyric acid ethyl ester Formula: C20H32N4O3 MolecularWeight: 376.49308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)N1CCCN(CC1)C2=NC(=NC(=C2C(C)C)C)C

Isomeric SMILES

CCOC(=O)CCC(=O)N1CCCN(CC1)C2=NC(=NC(=C2C(C)C)C)C

InChI

InChI=1S/C20H32N4O3/c1-6-27-18(26)9-8-17(25)23-10-7-11-24(13-12-23)20-19(14(2)3)15(4)21-16(5)22-20/h14H,6-13H2,1-5H3