1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(2,2-dimethyl-3-morpholin-4-yl-propoxy)phenyl]-5-methyl-pyrazole-4-carboxamide

Systemtic Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(2,2-dimethyl-3-morpholin-4-yl-propoxy)phenyl]-5-methyl-pyrazole-4-carboxamide Openeye Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(2,2-dimethyl-3-morpholino-propoxy)phenyl]-5-methyl-pyrazole-4-carboxamide CAS Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-[2,2-dimethyl-3-(4-morpholinyl)propoxy]phenyl]-5-methyl-4-pyrazolecarboxamide IUPAC Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(2,2-dimethyl-3-morpholin-4-ylpropoxy)phenyl]-5-methylpyrazole-4-carboxamide Traditional Name: 1-(1,3-benzodioxol-5-yl)-N-[3-cyano-4-(2,2-dimethyl-3-morpholino-propoxy)phenyl]-5-methyl-pyrazole-4-carboxamide Formula: C28H31N5O5 MolecularWeight: 517.57624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC(=C(C=C4)OCC(C)(C)CN5CCOCC5)C#N

Isomeric SMILES

CC1=C(C=NN1C2=CC3=C(C=C2)OCO3)C(=O)NC4=CC(=C(C=C4)OCC(C)(C)CN5CCOCC5)C#N

InChI

InChI=1S/C28H31N5O5/c1-19-23(15-30-33(19)22-5-7-25-26(13-22)38-18-37-25)27(34)31-21-4-6-24(20(12-21)14-29)36-17-28(2,3)16-32-8-10-35-11-9-32/h4-7,12-13,15H,8-11,16-18H2,1-3H3,(H,31,34)