N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-4-(4-chloranyl-3-methyl-phenoxy)butanamide

Systemtic Name: N-[6-azanyl-2,4-bis(oxidanylidene)-1-propyl-pyrimidin-5-yl]-N-butyl-4-(4-chloranyl-3-methyl-phenoxy)butanamide Openeye Name: N-(6-amino-2,4-dioxo-1-propyl-pyrimidin-5-yl)-N-butyl-4-(4-chloro-3-methyl-phenoxy)butanamide CAS Name: N-(6-amino-2,4-dioxo-1-propyl-5-pyrimidinyl)-N-butyl-4-(4-chloro-3-methylphenoxy)butanamide IUPAC Name: N-(6-amino-2,4-dioxo-1-propylpyrimidin-5-yl)-N-butyl-4-(4-chloro-3-methylphenoxy)butanamide Traditional Name: N-(6-amino-2,4-diketo-1-propyl-pyrimidin-5-yl)-N-butyl-4-(4-chloro-3-methyl-phenoxy)butyramide Formula: C22H31ClN4O4 MolecularWeight: 450.95894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CCCOC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CCCCN(C1=C(N(C(=O)NC1=O)CCC)N)C(=O)CCCOC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C22H31ClN4O4/c1-4-6-12-26(19-20(24)27(11-5-2)22(30)25-21(19)29)18(28)8-7-13-31-16-9-10-17(23)15(3)14-16/h9-10,14H,4-8,11-13,24H2,1-3H3,(H,25,29,30)