N-[(E)-(4-dimethylaminophenyl)methylideneamino]-3-(4-propoxyphenyl)-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-3-(4-propoxyphenyl)-1H-pyrazole-5-carboxamide Openeye Name: N-[(E)-(4-dimethylaminophenyl)methyleneamino]-3-(4-propoxyphenyl)-1H-pyrazole-5-carboxamide CAS Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-3-(4-propoxyphenyl)-1H-pyrazole-5-carboxamide IUPAC Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-3-(4-propoxyphenyl)-1H-pyrazole-5-carboxamide Traditional Name: N-[(E)-[4-(dimethylamino)benzylidene]amino]-3-(4-propoxyphenyl)-1H-pyrazole-5-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NN=CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NNC(=C2)C(=O)N/N=C/C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H25N5O2/c1-4-13-29-19-11-7-17(8-12-19)20-14-21(25-24-20)22(28)26-23-15-16-5-9-18(10-6-16)27(2)3/h5-12,14-15H,4,13H2,1-3H3,(H,24,25)(H,26,28)/b23-15+