3-azanyl-N-[5-[(6E)-2-azanyl-3-cyano-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-2-pyrrolidin-1-yl-phenyl]propanamide

Systemtic Name: 3-azanyl-N-[5-[(6E)-2-azanyl-3-cyano-6-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-2-pyrrolidin-1-yl-phenyl]propanamide Openeye Name: 3-amino-N-[5-[(6E)-2-amino-3-cyano-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-2-pyrrolidin-1-yl-phenyl]propanamide CAS Name: 3-amino-N-[5-[(6E)-2-amino-3-cyano-6-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-pyridin-4-yl]-2-(1-pyrrolidinyl)phenyl]propanamide IUPAC Name: 3-amino-N-[5-[(6E)-2-amino-3-cyano-6-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-2-pyrrolidin-1-ylphenyl]propanamide Traditional Name: 3-amino-N-[5-[(6E)-2-amino-3-cyano-6-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-pyridin-4-yl]-2-pyrrolidino-phenyl]propionamide Formula: C25H26N6O2 MolecularWeight: 442.51294

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C3=CC(=C4C=CC=CC4=O)NC(=C3C#N)N)NC(=O)CCN

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C3=C/C(=C\4/C=CC=CC4=O)/NC(=C3C#N)N)NC(=O)CCN

InChI

InChI=1S/C25H26N6O2/c26-10-9-24(33)29-21-13-16(7-8-22(21)31-11-3-4-12-31)18-14-20(30-25(28)19(18)15-27)17-5-1-2-6-23(17)32/h1-2,5-8,13-14,30H,3-4,9-12,26,28H2,(H,29,33)/b20-17+