N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-5-(4-fluorophenyl)thiophene-2-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-5-(4-fluorophenyl)thiophene-2-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-5-(4-fluorophenyl)thiophene-2-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-5-(4-fluorophenyl)-2-thiophenecarboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-5-(4-fluorophenyl)thiophene-2-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-5-(4-fluorophenyl)thiophene-2-carboxamide Formula: C23H27FN4O3S MolecularWeight: 458.548883

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27FN4O3S/c1-3-5-13-27(19-20(25)28(14-6-4-2)23(31)26-21(19)29)22(30)18-12-11-17(32-18)15-7-9-16(24)10-8-15/h7-12H,3-6,13-14,25H2,1-2H3,(H,26,29,31)