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

Systemtic Name: N-(4-bromophenyl)-N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-5-methyl-1H-pyrazole-4-carboxamide Openeye Name: N-(4-bromophenyl)-N-[3-cyano-4-(4-morpholino-1-piperidyl)phenyl]-5-methyl-1H-pyrazole-4-carboxamide CAS Name: N-(4-bromophenyl)-N-[3-cyano-4-[4-(4-morpholinyl)-1-piperidinyl]phenyl]-5-methyl-1H-pyrazole-4-carboxamide IUPAC Name: N-(4-bromophenyl)-N-[3-cyano-4-(4-morpholin-4-ylpiperidin-1-yl)phenyl]-5-methyl-1H-pyrazole-4-carboxamide Traditional Name: N-(4-bromophenyl)-N-[3-cyano-4-(4-morpholinopiperidino)phenyl]-5-methyl-1H-pyrazole-4-carboxamide Formula: C27H29BrN6O2 MolecularWeight: 549.46216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1)C(=O)N(C2=CC=C(C=C2)Br)C3=CC(=C(C=C3)N4CCC(CC4)N5CCOCC5)C#N

Isomeric SMILES

CC1=C(C=NN1)C(=O)N(C2=CC=C(C=C2)Br)C3=CC(=C(C=C3)N4CCC(CC4)N5CCOCC5)C#N

InChI

InChI=1S/C27H29BrN6O2/c1-19-25(18-30-31-19)27(35)34(23-4-2-21(28)3-5-23)24-6-7-26(20(16-24)17-29)33-10-8-22(9-11-33)32-12-14-36-15-13-32/h2-7,16,18,22H,8-15H2,1H3,(H,30,31)