N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-(4-chlorophenyl)carbonyl-N-methyl-piperidine-3-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-1-(4-chlorophenyl)carbonyl-N-methyl-piperidine-3-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-1-(4-chlorobenzoyl)-N-methyl-piperidine-3-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-1-[(4-chlorophenyl)-oxomethyl]-N-methyl-3-piperidinecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-1-(4-chlorobenzoyl)-N-methylpiperidine-3-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-1-(4-chlorobenzoyl)-N-methyl-nipecotamide Formula: C22H28ClN5O4 MolecularWeight: 461.94182

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(C)C(=O)C2CCCN(C2)C(=O)C3=CC=C(C=C3)Cl)N

InChI

InChI=1S/C22H28ClN5O4/c1-3-4-12-28-18(24)17(19(29)25-22(28)32)26(2)20(30)15-6-5-11-27(13-15)21(31)14-7-9-16(23)10-8-14/h7-10,15H,3-6,11-13,24H2,1-2H3,(H,25,29,32)