N-(2-cyano-4-cyclopentyl-5-oxidanyl-phenyl)-7-methyl-4-oxidanylidene-1H-pyrrolo[1,2-a]pyrimidine-3-carboxamide

Systemtic Name: N-(2-cyano-4-cyclopentyl-5-oxidanyl-phenyl)-7-methyl-4-oxidanylidene-1H-pyrrolo[1,2-a]pyrimidine-3-carboxamide Openeye Name: N-(2-cyano-4-cyclopentyl-5-hydroxy-phenyl)-7-methyl-4-oxo-1H-pyrrolo[1,2-a]pyrimidine-3-carboxamide CAS Name: N-(2-cyano-4-cyclopentyl-5-hydroxyphenyl)-7-methyl-4-oxo-1H-pyrrolo[1,2-a]pyrimidine-3-carboxamide IUPAC Name: N-(2-cyano-4-cyclopentyl-5-hydroxyphenyl)-7-methyl-4-oxo-1H-pyrrolo[1,2-a]pyrimidine-3-carboxamide Traditional Name: N-(2-cyano-4-cyclopentyl-5-hydroxy-phenyl)-4-keto-7-methyl-1H-pyrrolo[1,2-a]pyrimidine-3-carboxamide Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=C1)NC=C(C2=O)C(=O)NC3=CC(=C(C=C3C#N)C4CCCC4)O

Isomeric SMILES

CC1=CN2C(=C1)NC=C(C2=O)C(=O)NC3=CC(=C(C=C3C#N)C4CCCC4)O

InChI

InChI=1S/C21H20N4O3/c1-12-6-19-23-10-16(21(28)25(19)11-12)20(27)24-17-8-18(26)15(7-14(17)9-22)13-4-2-3-5-13/h6-8,10-11,13,23,26H,2-5H2,1H3,(H,24,27)