N-[2-(1-methylpyrazol-4-yl)ethyl]-2-[3-oxidanylidene-1-[(3-phenoxyphenyl)methyl]piperazin-2-yl]ethanamide

Systemtic Name: N-[2-(1-methylpyrazol-4-yl)ethyl]-2-[3-oxidanylidene-1-[(3-phenoxyphenyl)methyl]piperazin-2-yl]ethanamide Openeye Name: N-[2-(1-methylpyrazol-4-yl)ethyl]-2-[3-oxo-1-[(3-phenoxyphenyl)methyl]piperazin-2-yl]acetamide CAS Name: N-[2-(1-methyl-4-pyrazolyl)ethyl]-2-[3-oxo-1-[(3-phenoxyphenyl)methyl]-2-piperazinyl]acetamide IUPAC Name: N-[2-(1-methylpyrazol-4-yl)ethyl]-2-[3-oxo-1-[(3-phenoxyphenyl)methyl]piperazin-2-yl]acetamide Traditional Name: 2-[3-keto-1-(3-phenoxybenzyl)piperazin-2-yl]-N-[2-(1-methylpyrazol-4-yl)ethyl]acetamide Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CCNC(=O)CC2C(=O)NCCN2CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)CCNC(=O)CC2C(=O)NCCN2CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H29N5O3/c1-29-17-20(16-28-29)10-11-26-24(31)15-23-25(32)27-12-13-30(23)18-19-6-5-9-22(14-19)33-21-7-3-2-4-8-21/h2-9,14,16-17,23H,10-13,15,18H2,1H3,(H,26,31)(H,27,32)