5-cyano-5-methyl-3-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-phenethyl-1H-pyrazole-4-carboxamide

Systemtic Name: 5-cyano-5-methyl-3-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-phenethyl-1H-pyrazole-4-carboxamide Openeye Name: 5-cyano-5-methyl-3-[4-(4-morpholino-1-piperidyl)phenyl]-2-phenethyl-1H-pyrazole-4-carboxamide CAS Name: 5-cyano-5-methyl-3-[4-[4-(4-morpholinyl)-1-piperidinyl]phenyl]-2-phenethyl-1H-pyrazole-4-carboxamide IUPAC Name: 5-cyano-5-methyl-3-[4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-2-phenethyl-1H-pyrazole-4-carboxamide Traditional Name: 3-cyano-3-methyl-5-[4-(4-morpholinopiperidino)phenyl]-1-phenethyl-3-pyrazoline-4-carboxamide Formula: C29H36N6O2 MolecularWeight: 500.63514

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(N(N1)CCC2=CC=CC=C2)C3=CC=C(C=C3)N4CCC(CC4)N5CCOCC5)C(=O)N)C#N

Isomeric SMILES

CC1(C(=C(N(N1)CCC2=CC=CC=C2)C3=CC=C(C=C3)N4CCC(CC4)N5CCOCC5)C(=O)N)C#N

InChI

InChI=1S/C29H36N6O2/c1-29(21-30)26(28(31)36)27(35(32-29)16-11-22-5-3-2-4-6-22)23-7-9-24(10-8-23)33-14-12-25(13-15-33)34-17-19-37-20-18-34/h2-10,25,32H,11-20H2,1H3,(H2,31,36)