3-[4-[(2-butyl-4-oxidanylidene-5H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl]thiophene-2-carbonitrile

Systemtic Name: 3-[4-[(2-butyl-4-oxidanylidene-5H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl]thiophene-2-carbonitrile Openeye Name: 3-[4-[(2-butyl-4-oxo-5H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl]thiophene-2-carbonitrile CAS Name: 3-[4-[(2-butyl-4-oxo-5H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl]-2-thiophenecarbonitrile IUPAC Name: 3-[4-[(2-butyl-4-oxo-5H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl]thiophene-2-carbonitrile Traditional Name: 3-[4-[(2-butyl-4-keto-5H-imidazo[4,5-c]pyridin-3-yl)methyl]phenyl]thiophene-2-carbonitrile Formula: C22H20N4OS MolecularWeight: 388.4854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=C(SC=C4)C#N)C(=O)NC=C2

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=CC=C(C=C3)C4=C(SC=C4)C#N)C(=O)NC=C2

InChI

InChI=1S/C22H20N4OS/c1-2-3-4-20-25-18-9-11-24-22(27)21(18)26(20)14-15-5-7-16(8-6-15)17-10-12-28-19(17)13-23/h5-12H,2-4,14H2,1H3,(H,24,27)