ethyl 3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-carbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 3-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-pentyl-carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 3-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-pentyl-carbamoyl]piperidine-1-carboxylate CAS Name: 3-[[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-pentylamino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-pentylcarbamoyl]piperidine-1-carboxylate Traditional Name: 3-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-amyl-carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C22H37N5O5 MolecularWeight: 451.55968

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)C2CCCN(C2)C(=O)OCC

Isomeric SMILES

CCCCCN(C1=C(N(C(=O)NC1=O)CCCC)N)C(=O)C2CCCN(C2)C(=O)OCC

InChI

InChI=1S/C22H37N5O5/c1-4-7-9-14-26(17-18(23)27(13-8-5-2)21(30)24-19(17)28)20(29)16-11-10-12-25(15-16)22(31)32-6-3/h16H,4-15,23H2,1-3H3,(H,24,28,30)