N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-phenethyl-pyrazine-2-carboxamide

Systemtic Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-phenethyl-pyrazine-2-carboxamide Openeye Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxo-propyl]-N-phenethyl-pyrazine-2-carboxamide CAS Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-oxopropyl]-N-phenethyl-2-pyrazinecarboxamide IUPAC Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxopropyl]-N-phenethylpyrazine-2-carboxamide Traditional Name: N-[3-keto-3-(4-piperonylpiperazino)propyl]-N-phenethyl-pyrazinamide Formula: C28H31N5O4 MolecularWeight: 501.57684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCN(CCC4=CC=CC=C4)C(=O)C5=NC=CN=C5

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)C(=O)CCN(CCC4=CC=CC=C4)C(=O)C5=NC=CN=C5

InChI

InChI=1S/C28H31N5O4/c34-27(32-16-14-31(15-17-32)20-23-6-7-25-26(18-23)37-21-36-25)9-13-33(12-8-22-4-2-1-3-5-22)28(35)24-19-29-10-11-30-24/h1-7,10-11,18-19H,8-9,12-17,20-21H2