2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]-N-(1,3-benzodioxol-5-yl)ethanamide

Systemtic Name: 2-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]-N-(1,3-benzodioxol-5-yl)ethanamide Openeye Name: 2-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-pentyl-amino]-N-(1,3-benzodioxol-5-yl)acetamide CAS Name: 2-[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-pentylamino]-N-(1,3-benzodioxol-5-yl)acetamide IUPAC Name: 2-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-pentylamino]-N-(1,3-benzodioxol-5-yl)acetamide Traditional Name: 2-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-amyl-amino]-N-(1,3-benzodioxol-5-yl)acetamide Formula: C22H31N5O5 MolecularWeight: 445.51204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=O)NC1=CC2=C(C=C1)OCO2)C3=C(N(C(=O)NC3=O)CCCC)N

Isomeric SMILES

CCCCCN(CC(=O)NC1=CC2=C(C=C1)OCO2)C3=C(N(C(=O)NC3=O)CCCC)N

InChI

InChI=1S/C22H31N5O5/c1-3-5-7-10-26(19-20(23)27(11-6-4-2)22(30)25-21(19)29)13-18(28)24-15-8-9-16-17(12-15)32-14-31-16/h8-9,12H,3-7,10-11,13-14,23H2,1-2H3,(H,24,28)(H,25,29,30)