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

Systemtic Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxidanylidene-propyl]-N-cyclopropyl-pyrazine-2-carboxamide Openeye Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxo-propyl]-N-cyclopropyl-pyrazine-2-carboxamide CAS Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-3-oxopropyl]-N-cyclopropyl-2-pyrazinecarboxamide IUPAC Name: N-[3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-3-oxopropyl]-N-cyclopropylpyrazine-2-carboxamide Traditional Name: N-cyclopropyl-N-[3-keto-3-(4-piperonylpiperazino)propyl]pyrazinamide Formula: C23H27N5O4 MolecularWeight: 437.49158

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CCC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C(=O)C5=NC=CN=C5

Isomeric SMILES

C1CC1N(CCC(=O)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C(=O)C5=NC=CN=C5

InChI

InChI=1S/C23H27N5O4/c29-22(5-8-28(18-2-3-18)23(30)19-14-24-6-7-25-19)27-11-9-26(10-12-27)15-17-1-4-20-21(13-17)32-16-31-20/h1,4,6-7,13-14,18H,2-3,5,8-12,15-16H2