N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-chloranyl-N-(2-methoxyethyl)benzamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-3-chloranyl-N-(2-methoxyethyl)benzamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-3-chloro-N-(2-methoxyethyl)benzamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-3-chloro-N-(2-methoxyethyl)benzamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-3-chloro-N-(2-methoxyethyl)benzamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-3-chloro-N-(2-methoxyethyl)benzamide Formula: C18H23ClN4O4 MolecularWeight: 394.85262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC(=CC=C2)Cl)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCOC)C(=O)C2=CC(=CC=C2)Cl)N

InChI

InChI=1S/C18H23ClN4O4/c1-3-4-8-23-15(20)14(16(24)21-18(23)26)22(9-10-27-2)17(25)12-6-5-7-13(19)11-12/h5-7,11H,3-4,8-10,20H2,1-2H3,(H,21,24,26)