N-[(4-chlorophenyl)methyl]-1-methyl-6,8-bis(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide

Systemtic Name: N-[(4-chlorophenyl)methyl]-1-methyl-6,8-bis(morpholin-4-ylmethyl)-4-oxidanylidene-cinnoline-3-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-1-methyl-6,8-bis(morpholinomethyl)-4-oxo-cinnoline-3-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-1-methyl-6,8-bis(4-morpholinylmethyl)-4-oxo-3-cinnolinecarboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-1-methyl-6,8-bis(morpholin-4-ylmethyl)-4-oxocinnoline-3-carboxamide Traditional Name: N-(4-chlorobenzyl)-4-keto-1-methyl-6,8-bis(morpholinomethyl)cinnoline-3-carboxamide Formula: C27H32ClN5O4 MolecularWeight: 526.02708

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl)CN4CCOCC4)CN5CCOCC5

Isomeric SMILES

CN1C2=C(C=C(C=C2C(=O)C(=N1)C(=O)NCC3=CC=C(C=C3)Cl)CN4CCOCC4)CN5CCOCC5

InChI

InChI=1S/C27H32ClN5O4/c1-31-25-21(18-33-8-12-37-13-9-33)14-20(17-32-6-10-36-11-7-32)15-23(25)26(34)24(30-31)27(35)29-16-19-2-4-22(28)5-3-19/h2-5,14-15H,6-13,16-18H2,1H3,(H,29,35)