2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-ethyl-amino]-N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)ethanamide

Systemtic Name: 2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-ethyl-amino]-N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)ethanamide Openeye Name: 2-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-ethyl-amino]-N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)acetamide CAS Name: 2-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-ethylamino]-N-(3-cyano-1-cyclohexyl-4,5-dimethyl-2-pyrrolyl)acetamide IUPAC Name: 2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-ethylamino]-N-(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)acetamide Traditional Name: 2-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-ethyl-amino]-N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)acetamide Formula: C25H37N7O3 MolecularWeight: 483.60638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)CC(=O)NC2=C(C(=C(N2C3CCCCC3)C)C)C#N)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)CC(=O)NC2=C(C(=C(N2C3CCCCC3)C)C)C#N)N

InChI

InChI=1S/C25H37N7O3/c1-5-7-13-31-22(27)21(24(34)29-25(31)35)30(6-2)15-20(33)28-23-19(14-26)16(3)17(4)32(23)18-11-9-8-10-12-18/h18H,5-13,15,27H2,1-4H3,(H,28,33)(H,29,34,35)