5-bromanyl-N-[(6R)-1-ethyl-4-methyl-1,4-diazepan-6-yl]-2-methoxy-6-(methylamino)pyridine-3-carboxamide; (E)-but-2-enedioic acid

Systemtic Name: 5-bromanyl-N-[(6R)-1-ethyl-4-methyl-1,4-diazepan-6-yl]-2-methoxy-6-(methylamino)pyridine-3-carboxamide; (E)-but-2-enedioic acid Openeye Name: 5-bromo-N-[(6R)-1-ethyl-4-methyl-1,4-diazepan-6-yl]-2-methoxy-6-(methylamino)pyridine-3-carboxamide; fumaric acid CAS Name: 5-bromo-N-[(6R)-1-ethyl-4-methyl-1,4-diazepan-6-yl]-2-methoxy-6-(methylamino)-3-pyridinecarboxamide; (E)-2-butenedioic acid IUPAC Name: 5-bromo-N-[(6R)-1-ethyl-4-methyl-1,4-diazepan-6-yl]-2-methoxy-6-(methylamino)pyridine-3-carboxamide; (E)-but-2-enedioic acid Traditional Name: 5-bromo-N-[(6R)-1-ethyl-4-methyl-1,4-diazepan-6-yl]-2-methoxy-6-(methylamino)nicotinamide; fumaric acid Formula: C20H30BrN5O6 MolecularWeight: 516.3861

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC(C1)NC(=O)C2=CC(=C(N=C2OC)NC)Br)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCN1CCN(C[C@H](C1)NC(=O)C2=CC(=C(N=C2OC)NC)Br)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C16H26BrN5O2.C4H4O4/c1-5-22-7-6-21(3)9-11(10-22)19-15(23)12-8-13(17)14(18-2)20-16(12)24-4;5-3(6)1-2-4(7)8/h8,11H,5-7,9-10H2,1-4H3,(H,18,20)(H,19,23);1-2H,(H,5,6)(H,7,8)/b;2-1+/t11-;/m1./s1