2-[1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]ethanamide

Systemtic Name: 2-[1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]ethanamide Openeye Name: 2-[1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxo-piperazin-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]acetamide CAS Name: 2-[1-[(4-methoxy-3-methylphenyl)methyl]-3-oxo-2-piperazinyl]-N-[(5-methyl-2-pyrazinyl)methyl]acetamide IUPAC Name: 2-[1-[(4-methoxy-3-methylphenyl)methyl]-3-oxopiperazin-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]acetamide Traditional Name: 2-[3-keto-1-(4-methoxy-3-methyl-benzyl)piperazin-2-yl]-N-[(5-methylpyrazin-2-yl)methyl]acetamide Formula: C21H27N5O3 MolecularWeight: 397.47078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CN2CCNC(=O)C2CC(=O)NCC3=NC=C(N=C3)C)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CN2CCNC(=O)C2CC(=O)NCC3=NC=C(N=C3)C)OC

InChI

InChI=1S/C21H27N5O3/c1-14-8-16(4-5-19(14)29-3)13-26-7-6-22-21(28)18(26)9-20(27)25-12-17-11-23-15(2)10-24-17/h4-5,8,10-11,18H,6-7,9,12-13H2,1-3H3,(H,22,28)(H,25,27)