5-[(3-cyanophenyl)methylamino]-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide

Systemtic Name: 5-[(3-cyanophenyl)methylamino]-1-methyl-6-(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide Openeye Name: 5-[(3-cyanophenyl)methylamino]-1-methyl-6-(morpholinomethyl)-4-oxo-cinnoline-3-carboxamide CAS Name: 5-[(3-cyanophenyl)methylamino]-1-methyl-6-(4-morpholinylmethyl)-4-oxo-3-cinnolinecarboxamide IUPAC Name: 5-[(3-cyanophenyl)methylamino]-1-methyl-6-(morpholin-4-ylmethyl)-4-oxocinnoline-3-carboxamide Traditional Name: 5-[(3-cyanobenzyl)amino]-4-keto-1-methyl-6-(morpholinomethyl)cinnoline-3-carboxamide Formula: C23H24N6O3 MolecularWeight: 432.47506

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=C(C=C2)CN3CCOCC3)NCC4=CC=CC(=C4)C#N)C(=O)C(=N1)C(=O)N

Isomeric SMILES

CN1C2=C(C(=C(C=C2)CN3CCOCC3)NCC4=CC=CC(=C4)C#N)C(=O)C(=N1)C(=O)N

InChI

InChI=1S/C23H24N6O3/c1-28-18-6-5-17(14-29-7-9-32-10-8-29)20(19(18)22(30)21(27-28)23(25)31)26-13-16-4-2-3-15(11-16)12-24/h2-6,11,26H,7-10,13-14H2,1H3,(H2,25,31)