5-methyl-N-(3-methylbutyl)-N-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propyl]pyrazine-2-carboxamide

Systemtic Name: 5-methyl-N-(3-methylbutyl)-N-[3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propyl]pyrazine-2-carboxamide Openeye Name: N-[3-(4-benzylpiperazin-1-yl)-3-oxo-propyl]-N-isopentyl-5-methyl-pyrazine-2-carboxamide CAS Name: 5-methyl-N-(3-methylbutyl)-N-[3-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-5-methyl-N-(3-methylbutyl)pyrazine-2-carboxamide Traditional Name: N-[3-(4-benzylpiperazino)-3-keto-propyl]-N-isoamyl-5-methyl-pyrazinamide Formula: C25H35N5O2 MolecularWeight: 437.5777

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N(CCC(C)C)CCC(=O)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(CCC(C)C)CCC(=O)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C25H35N5O2/c1-20(2)9-11-30(25(32)23-18-26-21(3)17-27-23)12-10-24(31)29-15-13-28(14-16-29)19-22-7-5-4-6-8-22/h4-8,17-18,20H,9-16,19H2,1-3H3