butyl 4-[[5-cyano-4-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]methylcarbamoylamino]benzoate

Systemtic Name: butyl 4-[[5-cyano-4-methyl-2,6-bis(oxidanylidene)pyridin-3-ylidene]methylcarbamoylamino]benzoate Openeye Name: butyl 4-[(5-cyano-4-methyl-2,6-dioxo-3-pyridylidene)methylcarbamoylamino]benzoate CAS Name: 4-[[[(5-cyano-4-methyl-2,6-dioxo-3-pyridinylidene)methylamino]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(5-cyano-4-methyl-2,6-dioxopyridin-3-ylidene)methylcarbamoylamino]benzoate Traditional Name: 4-[(5-cyano-2,6-diketo-4-methyl-3-pyridylidene)methylcarbamoylamino]benzoic acid butyl ester Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)NC=C2C(=C(C(=O)NC2=O)C#N)C

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)NC=C2C(=C(C(=O)NC2=O)C#N)C

InChI

InChI=1S/C20H20N4O5/c1-3-4-9-29-19(27)13-5-7-14(8-6-13)23-20(28)22-11-16-12(2)15(10-21)17(25)24-18(16)26/h5-8,11H,3-4,9H2,1-2H3,(H2,22,23,28)(H,24,25,26)