4-cyano-2-methyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-5-pyrrol-1-yl-furan-3-carboxamide

Systemtic Name: 4-cyano-2-methyl-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-5-pyrrol-1-yl-furan-3-carboxamide Openeye Name: 4-cyano-2-methyl-N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-5-pyrrol-1-yl-furan-3-carboxamide CAS Name: 4-cyano-2-methyl-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-5-(1-pyrrolyl)-3-furancarboxamide IUPAC Name: 4-cyano-2-methyl-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-5-pyrrol-1-ylfuran-3-carboxamide Traditional Name: 4-cyano-N-[6-(3-ketopiperazino)-3-pyridyl]-2-methyl-5-pyrrol-1-yl-3-furamide Formula: C20H18N6O3 MolecularWeight: 390.39532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)NC3=CN=C(C=C3)N4CCNC(=O)C4

InChI

InChI=1S/C20H18N6O3/c1-13-18(15(10-21)20(29-13)25-7-2-3-8-25)19(28)24-14-4-5-16(23-11-14)26-9-6-22-17(27)12-26/h2-5,7-8,11H,6,9,12H2,1H3,(H,22,27)(H,24,28)