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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-butyl-5-chloranyl-2,3-dihydro-1,4-benzodioxine-7-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-butyl-5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-butyl-5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-butyl-5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-butyl-5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxamide Formula: C21H27ClN4O5 MolecularWeight: 450.91588

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC3=C(C(=C2)Cl)OCCO3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CCCC)C(=O)C2=CC3=C(C(=C2)Cl)OCCO3)N

InChI

InChI=1S/C21H27ClN4O5/c1-3-5-7-25(16-18(23)26(8-6-4-2)21(29)24-19(16)27)20(28)13-11-14(22)17-15(12-13)30-9-10-31-17/h11-12H,3-10,23H2,1-2H3,(H,24,27,29)