N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(3-ethoxypropylamino)-1-(4-methoxyphenyl)-2-oxidanylidene-ethyl]pyrazine-2-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(3-ethoxypropylamino)-1-(4-methoxyphenyl)-2-oxidanylidene-ethyl]pyrazine-2-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(3-ethoxypropylamino)-1-(4-methoxyphenyl)-2-oxo-ethyl]pyrazine-2-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(3-ethoxypropylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-2-pyrazinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(3-ethoxypropylamino)-1-(4-methoxyphenyl)-2-oxoethyl]pyrazine-2-carboxamide Traditional Name: N-[2-(3-ethoxypropylamino)-2-keto-1-(4-methoxyphenyl)ethyl]-N-piperonyl-pyrazinamide Formula: C27H30N4O6 MolecularWeight: 506.5503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C(C1=CC=C(C=C1)OC)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=NC=CN=C4

Isomeric SMILES

CCOCCCNC(=O)C(C1=CC=C(C=C1)OC)N(CC2=CC3=C(C=C2)OCO3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C27H30N4O6/c1-3-35-14-4-11-30-26(32)25(20-6-8-21(34-2)9-7-20)31(27(33)22-16-28-12-13-29-22)17-19-5-10-23-24(15-19)37-18-36-23/h5-10,12-13,15-16,25H,3-4,11,14,17-18H2,1-2H3,(H,30,32)