2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]-N-methyl-N-phenyl-ethanamide

Systemtic Name: 2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]-N-methyl-N-phenyl-ethanamide Openeye Name: 2-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-pentyl-amino]-N-methyl-N-phenyl-acetamide CAS Name: 2-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-pentylamino]-N-methyl-N-phenylacetamide IUPAC Name: 2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-pentylamino]-N-methyl-N-phenylacetamide Traditional Name: 2-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-amyl-amino]-N-methyl-N-phenyl-acetamide Formula: C22H33N5O3 MolecularWeight: 415.52912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)N(C)C1=CC=CC=C1)C2=C(N(C(=O)NC2=O)CCCC)N

Isomeric SMILES

CCCCCN(CC(=O)N(C)C1=CC=CC=C1)C2=C(N(C(=O)NC2=O)CCCC)N

InChI

InChI=1S/C22H33N5O3/c1-4-6-11-14-26(16-18(28)25(3)17-12-9-8-10-13-17)19-20(23)27(15-7-5-2)22(30)24-21(19)29/h8-10,12-13H,4-7,11,14-16,23H2,1-3H3,(H,24,29,30)