N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-6-bromanyl-N-propyl-2H-chromene-3-carboxamide

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-6-bromanyl-N-propyl-2H-chromene-3-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-6-bromo-N-propyl-2H-chromene-3-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-6-bromo-N-propyl-2H-1-benzopyran-3-carboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-6-bromo-N-propyl-2H-chromene-3-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-6-bromo-N-propyl-2H-chromene-3-carboxamide Formula: C21H25BrN4O4 MolecularWeight: 477.3516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCC)C(=O)C2=CC3=C(C=CC(=C3)Br)OC2)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCC)C(=O)C2=CC3=C(C=CC(=C3)Br)OC2)N

InChI

InChI=1S/C21H25BrN4O4/c1-3-5-9-26-18(23)17(19(27)24-21(26)29)25(8-4-2)20(28)14-10-13-11-15(22)6-7-16(13)30-12-14/h6-7,10-11H,3-5,8-9,12,23H2,1-2H3,(H,24,27,29)