N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-[(E)-(2,4-dichlorophenyl)methylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-N-[(E)-(2,4-dichlorophenyl)methylideneamino]pyridine-4-carboxamide Openeye Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxo-ethyl]-N-[(E)-(2,4-dichlorophenyl)methyleneamino]pyridine-4-carboxamide CAS Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-2-oxoethyl]-N-[(E)-(2,4-dichlorophenyl)methylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-oxoethyl]-N-[(E)-(2,4-dichlorophenyl)methylideneamino]pyridine-4-carboxamide Traditional Name: N-[(E)-(2,4-dichlorobenzylidene)amino]-N-[2-keto-2-(4-piperonylpiperazino)ethyl]isonicotinamide Formula: C27H25Cl2N5O4 MolecularWeight: 554.4245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CN(C(=O)C4=CC=NC=C4)N=CC5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CN(C(=O)C4=CC=NC=C4)/N=C/C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C27H25Cl2N5O4/c28-22-3-2-21(23(29)14-22)15-31-34(27(36)20-5-7-30-8-6-20)17-26(35)33-11-9-32(10-12-33)16-19-1-4-24-25(13-19)38-18-37-24/h1-8,13-15H,9-12,16-18H2/b31-15+