methyl 2-[[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-[[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-amino]methyl]furan-3-carboxylate Openeye Name: methyl 2-[[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-pentyl-amino]methyl]furan-3-carboxylate CAS Name: 2-[[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-pentylamino]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-pentylamino]methyl]furan-3-carboxylate Traditional Name: 2-[[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-amyl-amino]methyl]furan-3-carboxylic acid methyl ester Formula: C20H30N4O5 MolecularWeight: 406.476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=C(C=CO1)C(=O)OC)C2=C(N(C(=O)NC2=O)CCCC)N

Isomeric SMILES

CCCCCN(CC1=C(C=CO1)C(=O)OC)C2=C(N(C(=O)NC2=O)CCCC)N

InChI

InChI=1S/C20H30N4O5/c1-4-6-8-10-23(13-15-14(9-12-29-15)19(26)28-3)16-17(21)24(11-7-5-2)20(27)22-18(16)25/h9,12H,4-8,10-11,13,21H2,1-3H3,(H,22,25,27)