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

Systemtic Name: 2-[1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxidanylidene-piperazin-2-yl]-N-(3-pyrazol-1-ylpropyl)ethanamide Openeye Name: 2-[1-[(4-methoxy-3-methyl-phenyl)methyl]-3-oxo-piperazin-2-yl]-N-(3-pyrazol-1-ylpropyl)acetamide CAS Name: 2-[1-[(4-methoxy-3-methylphenyl)methyl]-3-oxo-2-piperazinyl]-N-[3-(1-pyrazolyl)propyl]acetamide IUPAC Name: 2-[1-[(4-methoxy-3-methylphenyl)methyl]-3-oxopiperazin-2-yl]-N-(3-pyrazol-1-ylpropyl)acetamide Traditional Name: 2-[3-keto-1-(4-methoxy-3-methyl-benzyl)piperazin-2-yl]-N-(3-pyrazol-1-ylpropyl)acetamide Formula: C21H29N5O3 MolecularWeight: 399.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CN2CCNC(=O)C2CC(=O)NCCCN3C=CC=N3)OC

Isomeric SMILES

CC1=C(C=CC(=C1)CN2CCNC(=O)C2CC(=O)NCCCN3C=CC=N3)OC

InChI

InChI=1S/C21H29N5O3/c1-16-13-17(5-6-19(16)29-2)15-25-12-9-23-21(28)18(25)14-20(27)22-7-3-10-26-11-4-8-24-26/h4-6,8,11,13,18H,3,7,9-10,12,14-15H2,1-2H3,(H,22,27)(H,23,28)