N-[3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide

Systemtic Name: N-[3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide Openeye Name: N-[3-cyano-4-(4-tetrahydropyran-4-ylpiperazin-1-yl)phenyl]-5-methyl-1H-pyrazole-4-carboxamide CAS Name: N-[3-cyano-4-[4-(4-oxanyl)-1-piperazinyl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide IUPAC Name: N-[3-cyano-4-[4-(oxan-4-yl)piperazin-1-yl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide Traditional Name: N-[3-cyano-4-(4-tetrahydropyran-4-ylpiperazino)phenyl]-5-methyl-1H-pyrazole-4-carboxamide Formula: C21H26N6O2 MolecularWeight: 394.47014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C4CCOCC4)C#N

Isomeric SMILES

CC1=C(C=NN1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C4CCOCC4)C#N

InChI

InChI=1S/C21H26N6O2/c1-15-19(14-23-25-15)21(28)24-17-2-3-20(16(12-17)13-22)27-8-6-26(7-9-27)18-4-10-29-11-5-18/h2-3,12,14,18H,4-11H2,1H3,(H,23,25)(H,24,28)