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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-3-chloranyl-6-fluoranyl-1-benzothiophene-2-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-3-chloro-6-fluoro-benzothiophene-2-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-3-chloro-6-fluoro-1-benzothiophene-2-carboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-3-chloro-6-fluoro-1-benzothiophene-2-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-3-chloro-6-fluoro-benzothiophene-2-carboxamide Formula: C21H24ClFN4O3S MolecularWeight: 466.956663

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=C(C3=C(S2)C=C(C=C3)F)Cl)N

InChI

InChI=1S/C21H24ClFN4O3S/c1-3-5-9-26(16-18(24)27(10-6-4-2)21(30)25-19(16)28)20(29)17-15(22)13-8-7-12(23)11-14(13)31-17/h7-8,11H,3-6,9-10,24H2,1-2H3,(H,25,28,30)