N-[(E)-(4-dimethylaminophenyl)methylideneamino]-5-(2-propoxyphenyl)pyrazolidine-3-carboxamide

Systemtic Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-5-(2-propoxyphenyl)pyrazolidine-3-carboxamide Openeye Name: N-[(E)-(4-dimethylaminophenyl)methyleneamino]-5-(2-propoxyphenyl)pyrazolidine-3-carboxamide CAS Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-5-(2-propoxyphenyl)-3-pyrazolidinecarboxamide IUPAC Name: N-[(E)-(4-dimethylaminophenyl)methylideneamino]-5-(2-propoxyphenyl)pyrazolidine-3-carboxamide Traditional Name: N-[(E)-[4-(dimethylamino)benzylidene]amino]-5-(2-propoxyphenyl)pyrazolidine-3-carboxamide Formula: C22H29N5O2 MolecularWeight: 395.49796

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2CC(NN2)C(=O)NN=CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CCCOC1=CC=CC=C1C2CC(NN2)C(=O)N/N=C/C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C22H29N5O2/c1-4-13-29-21-8-6-5-7-18(21)19-14-20(25-24-19)22(28)26-23-15-16-9-11-17(12-10-16)27(2)3/h5-12,15,19-20,24-25H,4,13-14H2,1-3H3,(H,26,28)/b23-15+