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

Systemtic Name: N-[6-azanyl-1-butyl-2,4-bis(oxidanylidene)pyrimidin-5-yl]-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-(6-amino-1-butyl-2,4-dioxo-pyrimidin-5-yl)-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-(6-amino-1-butyl-2,4-dioxo-5-pyrimidinyl)-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-(6-amino-1-butyl-2,4-dioxopyrimidin-5-yl)-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-(6-amino-1-butyl-2,4-diketo-pyrimidin-5-yl)-N-ethyl-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C20H26N4O5 MolecularWeight: 402.44424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)C2=CC3=C(C=C2)OCCCO3)N

Isomeric SMILES

CCCCN1C(=C(C(=O)NC1=O)N(CC)C(=O)C2=CC3=C(C=C2)OCCCO3)N

InChI

InChI=1S/C20H26N4O5/c1-3-5-9-24-17(21)16(18(25)22-20(24)27)23(4-2)19(26)13-7-8-14-15(12-13)29-11-6-10-28-14/h7-8,12H,3-6,9-11,21H2,1-2H3,(H,22,25,27)