4-[bis(azanyl)methylidene]-2-[[(7-pyrrolidin-1-ylcarbonylquinazolin-4-yl)amino]methyl]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[bis(azanyl)methylidene]-2-[[(7-pyrrolidin-1-ylcarbonylquinazolin-4-yl)amino]methyl]cyclohexa-2,5-dien-1-one Openeye Name: 4-(diaminomethylene)-2-[[[7-(pyrrolidine-1-carbonyl)quinazolin-4-yl]amino]methyl]cyclohexa-2,5-dien-1-one CAS Name: 4-(diaminomethylidene)-2-[[[7-[oxo(1-pyrrolidinyl)methyl]-4-quinazolinyl]amino]methyl]-1-cyclohexa-2,5-dienone IUPAC Name: 4-(diaminomethylidene)-2-[[[7-(pyrrolidine-1-carbonyl)quinazolin-4-yl]amino]methyl]cyclohexa-2,5-dien-1-one Traditional Name: 4-(diaminomethylene)-2-[[[7-(pyrrolidine-1-carbonyl)quinazolin-4-yl]amino]methyl]cyclohexa-2,5-dien-1-one Formula: C21H22N6O2 MolecularWeight: 390.43838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC3=C(C=C2)C(=NC=N3)NCC4=CC(=C(N)N)C=CC4=O

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC3=C(C=C2)C(=NC=N3)NCC4=CC(=C(N)N)C=CC4=O

InChI

InChI=1S/C21H22N6O2/c22-19(23)13-4-6-18(28)15(9-13)11-24-20-16-5-3-14(10-17(16)25-12-26-20)21(29)27-7-1-2-8-27/h3-6,9-10,12H,1-2,7-8,11,22-23H2,(H,24,25,26)