N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-7-chloranyl-3-methyl-1-benzofuran-2-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-7-chloranyl-3-methyl-1-benzofuran-2-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-7-chloro-3-methyl-benzofuran-2-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-7-chloro-3-methyl-2-benzofurancarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-7-chloro-3-methyl-1-benzofuran-2-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-7-chloro-3-methyl-coumarilamide Formula: C22H27ClN4O4 MolecularWeight: 446.92718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=C(C3=C(O2)C(=CC=C3)Cl)C)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=C(C3=C(O2)C(=CC=C3)Cl)C)N

InChI

InChI=1S/C22H27ClN4O4/c1-4-6-11-26(16-19(24)27(12-7-5-2)22(30)25-20(16)28)21(29)17-13(3)14-9-8-10-15(23)18(14)31-17/h8-10H,4-7,11-12,24H2,1-3H3,(H,25,28,30)