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

Systemtic Name: ethyl 4-[[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-butyl-carbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 4-[(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-butyl-carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-butylamino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-butylcarbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-butyl-carbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C21H35N5O5 MolecularWeight: 437.5331

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2CCN(CC2)C(=O)OCC)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2CCN(CC2)C(=O)OCC)N

InChI

InChI=1S/C21H35N5O5/c1-4-7-11-25(16-17(22)26(12-8-5-2)20(29)23-18(16)27)19(28)15-9-13-24(14-10-15)21(30)31-6-3/h15H,4-14,22H2,1-3H3,(H,23,27,29)